Berger, Michael’s team published research in Chemical Science in 11 | CAS: 163839-73-4

Chemical Science published new progress about 163839-73-4. 163839-73-4 belongs to catalysis-chemistry, auxiliary class Trifluoromethyl,Fluoride,Carboxylic acid,Benzene,Ether, name is 2-(4-(Trifluoromethyl)phenoxy)acetic acid, and the molecular formula is C9H7F3O3, Synthetic Route of 163839-73-4.

Berger, Michael published the artcileMetal-free electrochemical fluorodecarboxylation of aryloxyacetic acids to fluoromethyl aryl ethers, Synthetic Route of 163839-73-4, the publication is Chemical Science (2020), 11(23), 6053-6057, database is CAplus and MEDLINE.

Electrochem. decarboxylation of aryloxyacetic acids followed by fluorination provided easy access to fluoromethyl aryl ethers. This electrochem. fluorodecarboxylation offers a sustainable approach with elec. current as traceless oxidant. Using Et3N¡¤5HF as fluoride source and as supporting electrolyte, this simple electrosynthesis afforded various fluoromethoxyarenes in yields up to 85%.

Chemical Science published new progress about 163839-73-4. 163839-73-4 belongs to catalysis-chemistry, auxiliary class Trifluoromethyl,Fluoride,Carboxylic acid,Benzene,Ether, name is 2-(4-(Trifluoromethyl)phenoxy)acetic acid, and the molecular formula is C9H7F3O3, Synthetic Route of 163839-73-4.

Referemce:
https://courses.lumenlearning.com/boundless-chemistry/chapter/catalysis/,
Catalysis – Wikipedia

Berger, Michael’s team published research in Chemical Science in 11 | CAS: 1798-04-5

Chemical Science published new progress about 1798-04-5. 1798-04-5 belongs to catalysis-chemistry, auxiliary class Carboxylic acid,Benzene,Ether, name is 2-(4-(tert-Butyl)phenoxy)acetic acid, and the molecular formula is C12H16O3, Recommanded Product: 2-(4-(tert-Butyl)phenoxy)acetic acid.

Berger, Michael published the artcileMetal-free electrochemical fluorodecarboxylation of aryloxyacetic acids to fluoromethyl aryl ethers, Recommanded Product: 2-(4-(tert-Butyl)phenoxy)acetic acid, the publication is Chemical Science (2020), 11(23), 6053-6057, database is CAplus and MEDLINE.

Electrochem. decarboxylation of aryloxyacetic acids followed by fluorination provided easy access to fluoromethyl aryl ethers. This electrochem. fluorodecarboxylation offers a sustainable approach with elec. current as traceless oxidant. Using Et3N¡¤5HF as fluoride source and as supporting electrolyte, this simple electrosynthesis afforded various fluoromethoxyarenes in yields up to 85%.

Chemical Science published new progress about 1798-04-5. 1798-04-5 belongs to catalysis-chemistry, auxiliary class Carboxylic acid,Benzene,Ether, name is 2-(4-(tert-Butyl)phenoxy)acetic acid, and the molecular formula is C12H16O3, Recommanded Product: 2-(4-(tert-Butyl)phenoxy)acetic acid.

Referemce:
https://courses.lumenlearning.com/boundless-chemistry/chapter/catalysis/,
Catalysis – Wikipedia

Kim, Jaeseung’s team published research in Journal of Organic Chemistry in 70 | CAS: 312-40-3

Journal of Organic Chemistry published new progress about 312-40-3. 312-40-3 belongs to catalysis-chemistry, auxiliary class Organic Silicones, name is Difluorodiphenylsilane, and the molecular formula is C12H10F2Si, Safety of Difluorodiphenylsilane.

Kim, Jaeseung published the artcileSilanediol Inhibitors of Angiotensin-Converting Enzyme. Synthesis and Evaluation of Four Diastereomers of Phe[Si]Ala Dipeptide Analogues, Safety of Difluorodiphenylsilane, the publication is Journal of Organic Chemistry (2005), 70(15), 5781-5789, database is CAplus and MEDLINE.

Phe-Ala silanediol dipeptide mimics I as four diastereoisomers [(S,S)-, (S,R)-, (R,R)- and (R,S)-I] have been evaluated as inhibitors of angiotensin-converting enzyme (ACE) and compared to ketone-based inhibitors II reported by Almquist et al. One stereogenic center of the isomers was derived from the individual enantiomers of Me 3-hydroxy-2-methylpropionate, with separation of diastereomers after introduction of the second stereogenic center. The diastereomeric identities were established by x-ray crystallog. of an intermediate. Inhibition of ACE by (S,S)-I, (R,R)-I, (R,S)-I diastereomers (IC50 = 3.8 – 207 nM) closely paralleled that of the corresponding diastereomeric ketones II (IC50 = 1.0 – 46 nM). (S,R)-I, corresponding to the least inhibitory ketone (IC50 = 3200 nM), exhibited an unexpected level of inhibition in the silanediol (IC50 = 72 nM), suggesting an alternative mode of binding to the enzyme.

Journal of Organic Chemistry published new progress about 312-40-3. 312-40-3 belongs to catalysis-chemistry, auxiliary class Organic Silicones, name is Difluorodiphenylsilane, and the molecular formula is C12H10F2Si, Safety of Difluorodiphenylsilane.

Referemce:
https://courses.lumenlearning.com/boundless-chemistry/chapter/catalysis/,
Catalysis – Wikipedia

Hill, Carl M.’s team published research in Journal of the American Chemical Society in 75 | CAS: 1798-04-5

Journal of the American Chemical Society published new progress about 1798-04-5. 1798-04-5 belongs to catalysis-chemistry, auxiliary class Carboxylic acid,Benzene,Ether, name is 2-(4-(tert-Butyl)phenoxy)acetic acid, and the molecular formula is C12H16O3, Product Details of C12H16O3.

Hill, Carl M. published the artcileThe synthesis, properties, and catalytic hydrogenation of several aryloxy substituted ketene monomers and dimers, Product Details of C12H16O3, the publication is Journal of the American Chemical Society (1953), 1084-6, database is CAplus.

p-Me3CC6H4ONa treated with EtCHBrCO2Et in MeOH gave p-Me3CC6H4OCHEtCO2Et which was hydrolyzed to the corresponding acid (I), 63%, m. 87-8.5¡ã (from petr. ether-C6H6) (all m.ps. reported are corrected). Similarly were obtained: p-Me3CC6H4CHBuCO2H, 69%, m. 89-90¡ã, and p-Me3CC6H4CHAmCO2H, 63%, m. 72-3¡ã. The ¦Á-aryloxy acids were converted with SOCl2 to the corresponding acyl chlorides, p-Me3CC6H4OCHRCOCl (II) (R, b.p./mm., % yield, n20D, and d20 given): H (III), 130-2¡ã/5, 90, 1.5162, 1.1128, from p-tert-BuC6H4OCH2CO2H, m. 88-9¡ã; Me (IV), 143-5¡ã/26, 60, 1.5092, 1.0775, from p-Me3CC6H4OCHMeCO2H, m. 86-7¡ã; Et, 131-2¡ã/3, 94, 1.5055, 1.0651; Bu, 143-4¡ã/3, 95, 1.5018, 1.0641; and Am, 149-50¡ã/6, 97, 1.5003, 0.9984. To 0.5 g. II in 100 cc. dry Et2O was added dry NH3 and the crude precipitate filtered off and recrystallized from MeOH to give the amides p-Me3CC6H4OCHRCONH2 (R, m.p., and % yield given): H, 131-2¡ã, 86; Me, 116-17¡ã, 91; Et, 97-9¡ã, 87; Bu, 145-6¡ã, 71; and Am, 86-7¡ã, 76. III in 20 cc. dry C6H6 warmed with an equivalent amount PhNH2 on the water bath gave p-Me3CC6H4OCH2CONHPh, m. 91-2¡ã. Similarly was prepared p-Me3CC6H4OCHMeCONHPh, m. 83-4¡ã. The dehydrochlorination of III as previously described (cf. C.A. 45, 10128i) gave 37% p-tert-butylphenoxyketene dimer (V), m. 85-6¡ã, b5 180-3¡ã. IV gave similarly 55% p-tert-butylphenoxymethylketene dimer (VI), m. 78-9¡ã, b6 147-50¡ã. By the same procedure were prepared the following p-tert-butylphenoxyalkylketene monomers (alkyl, b.p./mm., % yield, n20D, and d20 given): Et (VII), 175-6¡ã/12, 66, 1.5178, 1.0132; Bu (VIII), 169-71¡ã/10, 54, 1.5044, 1.0157; and Am (IX), 132-3¡ã/5, 73, 1.5056, 0.9771. Weighed samples of the ketenes (5-15 g.) in 25 cc. petr. ether were hydrogenated 4-6 hrs. over 2-4 g. Raney Ni at 1500-3500 lb./sq. in. pressure, the mixture filtered, the solvent distilled off, the residue distilled, and the glycol fraction washed with small portions 15% aqueous Na2CO3 and H2O, dried with MgSO4, and redistilled, giving 2 fractions, p-Me3CC6H4OH, m. 94-5¡ã (from petr. ether-C6H6), and glycols corresponding to the ketene dimer. In the case of V, the p-Me3C6H4 was not split off and the only product was 2,4-bis(p-tert-butylphenoxy)-1,3-butanediol dimer, m. 88-9¡ã ; bis(3,5-dinitrobenzoate), m. 140-1¡ã. VI gave by hydrogenation 50% CHMe.CH(OH).CHMe.CHOH, b20 83-4¡ã n20D 1.5328, d20 1.0570; bis(3,5-dinitrobenzoate), 40%, m. 126-7¡ã. The other ketenes were converted similarly to the corresponding CHR.CH(OH).CHR.CHOH (X) [R, % yield, b.p./mm., n20D, d20, and, in parentheses, the % yield and m.p. of the bis(3,5-dinitrobenzoate), given]: Et, 65, 75-7¡ã/10, 1.4458, 0.9165 (37, 165-6¡ã); Bu, 40, 125-6¡ã/3, 1.4343, 0.9108 (35, 162-3¡ã); and Am, 35, 125-7¡ã/5, 1.4388, 0.8957 (50, 163-4¡ã). The 2 isomeric forms of the previously prepared (2,4-Cl2C6H3OCR:C:O)2 (XI), where R is Et, Pr, and Bu, gave by the same procedure the following pairs of isomeric X [R, % yield, b.p./mm., n20D (except where otherwise stated), d20 values and in parentheses, the % yield and m.p. of the bis(p-nitrobenzoate) given]: Et, 55, 60-3¡ã/3, n21D 1.5228, 1.0018 (48, 118-19¡ã), and 40% 2,4-Cl2C6H3OH (XII), m. 42-3¡ã (3,5-dinitrobenzoate, m. 142-3¡ã), from liquid XI with R = Et; Et, 20, 59-61¡ã/3, 1.5362, 1.0784, MRD 41.64 (54, 85-6¡ã), and 35% XII from solid XI with R = Et; Pr, 20, m. 21-3¡ã, 63-5¡ã/3, n25D 1.5362, 1.0757 (56, 88-90¡ã), and 65% XII from liquid XI with R = Pr; Pr, 67, 102-4¡ã/3, 1.5261, 1.0612, MRD 49.76 (68, 114-15¡ã), and 28% XII from solid XI with R = Pr; Bu, 27, 62¡ã/4, 1.5183, 1.0688, MRD) 56.73 (45, 115-16¡ã), and 45% XII from liquid XI with R = Bu; and Bu, 56, 65-8¡ã/2, 1.5299, 1.0378, MRD 59.53 (61, 119-20¡ã), and 38% XII from solid XI with R = Bu.

Journal of the American Chemical Society published new progress about 1798-04-5. 1798-04-5 belongs to catalysis-chemistry, auxiliary class Carboxylic acid,Benzene,Ether, name is 2-(4-(tert-Butyl)phenoxy)acetic acid, and the molecular formula is C12H16O3, Product Details of C12H16O3.

Referemce:
https://courses.lumenlearning.com/boundless-chemistry/chapter/catalysis/,
Catalysis – Wikipedia

Tamao, Kohei’s team published research in Organometallics in 11 | CAS: 312-40-3

Organometallics published new progress about 312-40-3. 312-40-3 belongs to catalysis-chemistry, auxiliary class Organic Silicones, name is Difluorodiphenylsilane, and the molecular formula is C9H7NO2, Quality Control of 312-40-3.

Tamao, Kohei published the artcileElectronic and steric effects in pentacoordinate anionic diorganotrifluorosilicates: x-ray structures and carbon-13 NMR studies for evaluation of charge distribution in aryl groups on silicon, Quality Control of 312-40-3, the publication is Organometallics (1992), 11(1), 182-91, database is CAplus.

A series of diorganotrifluorosilicates, (4-XC6H4)MeSiF3 (I), (4-XC6H4)PhSiF3 (II), (MenC6H5-n)PhSiF3, (2-MeC6H4)(4-MeC6H4)SiF3 (III), and (2,6-Me2C6H3)(3,5-Me2C6H3)SiF3 (IV) with the 18-crown-6 potassium countercation were prepared Mol. structures of II (X = CF3, Me, MeO, Me2N), III, and IV were determined by X-ray crystallog., confirming trigonal-bipyramidal structures. The dihedral angle between the substituted Ph group and the equatorial plane depends not on the electronic effect but on the steric effect. Variable-temperature 19F NMR studies on II provide the electronic effects on energy barriers for pseudorotation. In 13C NMR studies, all carbon chem. shifts were observed and assigned unambiguously: the Si ipso carbons of aromatic rings and the Me group were observed for the first time. Changes in chem. shifts ¦¤¦Ä(C) of anionic pentacoordinate silicates, I and II, vs. the corresponding neutral tetracoordinate silanes are +17 to +20 ppm for Si ipso (C1), +3 to +4 ppm for ortho (C2), -3 ppm for meta (C3), -4 to -7 ppm for para (C4), and +9 ppm for Me carbon. The charge distribution in the Ph groups in silicates is discussed in terms of the electron-donating nature by the SiRF3 group via the ¦Ð polarization effect. There are linear correlations of the chem. shifts of Si ipso C1 (para to X) in the para-substituted Ph groups and Si ipso C1′ in the parent Ph groups in II and (4-XC6H4)PhSiF2 with the Hammett ¦Òp+, from which are estimated the relative electron densities on Si ipso carbons C1 and C1′.

Organometallics published new progress about 312-40-3. 312-40-3 belongs to catalysis-chemistry, auxiliary class Organic Silicones, name is Difluorodiphenylsilane, and the molecular formula is C9H7NO2, Quality Control of 312-40-3.

Referemce:
https://courses.lumenlearning.com/boundless-chemistry/chapter/catalysis/,
Catalysis – Wikipedia

Tamao, Kohei’s team published research in Journal of Organometallic Chemistry in 506 | CAS: 312-40-3

Journal of Organometallic Chemistry published new progress about 312-40-3. 312-40-3 belongs to catalysis-chemistry, auxiliary class Organic Silicones, name is Difluorodiphenylsilane, and the molecular formula is C13H16O2, SDS of cas: 312-40-3.

Tamao, Kohei published the artcileAnion complexation by bidentate Lewis acidic hosts, ortho-bis(fluorosilyl)benzenes, SDS of cas: 312-40-3, the publication is Journal of Organometallic Chemistry (1996), 506(1-2), 85-91, database is CAplus.

Ortho-bis(fluorosilyl)benzenes (precursors for bis-siliconates: o-C6H4(SiPhF2)2 (1), o-C6H4(SiF3)(SiPh2F) (2), o-C6H4(SiPhF2)(SiPh2F) (3)) possess anion binding properties as bidentate Lewis acidic hosts in organic solvents. Compound 1 quant. binds a F ion from KF suspended in acetone or THF without support of 18-crown-6 to form the corresponding soluble bis-siliconate [o-C6H4(SiPhF2)2F]K (4). The binding constants of F by a series of fluorosilanes were measured by 1H and 19F NMR spectroscopies. The affinity of fluorosilanes towards F increases in the order PhMeSiF2 (7)<Ph2SiF2 (9)<3<1<2. The fluoride ion binding constant of 2 is estimated to be K > 1.1 ¡Á 109 M-1 at 193 K. These bidentate Lewis acids 13 are among the strongest organic hosts for a fluoride ion in organic solvents ever reported.

Journal of Organometallic Chemistry published new progress about 312-40-3. 312-40-3 belongs to catalysis-chemistry, auxiliary class Organic Silicones, name is Difluorodiphenylsilane, and the molecular formula is C13H16O2, SDS of cas: 312-40-3.

Referemce:
https://courses.lumenlearning.com/boundless-chemistry/chapter/catalysis/,
Catalysis – Wikipedia

Dunn, Simon C.’s team published research in Organometallics in 25 | CAS: 22693-41-0

Organometallics published new progress about 22693-41-0. 22693-41-0 belongs to catalysis-chemistry, auxiliary class Other Functionalization Reagent, name is 2,4,6-Triisopropylbenzenethiol, and the molecular formula is C15H24S, Recommanded Product: 2,4,6-Triisopropylbenzenethiol.

Dunn, Simon C. published the artcileSynthesis and Reactions of Group 4 Imido Complexes Supported by Cyclooctatetraene Ligands, Recommanded Product: 2,4,6-Triisopropylbenzenethiol, the publication is Organometallics (2006), 25(7), 1755-1770, database is CAplus.

The reactions of the pseudo-two-coordinate Ti imido complexes [Ti(NtBu)(COT)] (1) (COT = ¦Ç8-C8H8), [Ti(NtBu)(COT”)] (2) (COT” = ¦Ç8-1,4-C8H6(SiMe3)2), and [Ti(NAr)(COT)] (3) (Ar = 2,6-iPr2C6H3) with a variety of organic substrates are reported. Reaction of 1 with CO2, tBuNCO, or ArNCO and reaction of 3 with CO2 or tBuNCO afforded the organic products tBuNCO, tBuNCNtBu, tBuNCNAr, ArNCO, and ArNCNtBu, resp., and a Ti oxo species. These reactions proceeded via an initial [2 + 2] cycloaddition to form an N,O-bound intermediate [Ti{N(R)C(O)R’}(COT)], which subsequently underwent a retrocycloaddn. to give an organic product and the Ti oxo species. In contrast, reaction of 3 with ArNCO gave the N,N-bound [2 + 2] cycloaddition product [Ti{N(Ar)C(O)N(Ar)}(COT)] (7). In general, the reactions of 1 and 3 with CS2 and isothiocyanates also resulted in an initial [2 + 2] cycloaddition to form an N,S-bound intermediate [Ti{N(R)C(S)R’}(COT)], which also subsequently underwent a retrocycloaddn. to give an organic product and a metal sulfide species. However, the N,S-bound compound [Ti{N(Ar)C(S)S}(COT)] (10) was stable to retrocycloaddn. and was isolated. Proton transfer reactions occurred between pinacol and compounds 13 to form the bis(alkoxide) species [Ti{OC(Me)2C(Me)2O}(COT)] (11) (from 1 or 3) or [Ti{OC(Me)2C(Me)2O}(COT”)] (12) (from 2) and the corresponding free amine. The reactions between 13 and 2 equiv of the thiols tBuSH and HS-2,4,6-iPr3C6H2 all resulted in the oxidation of the thiol to the disulfides tBuS-StBu and (2,4,6-iPr3C6H2)S-S(2,4,6-iPr3C6H2). Treatment of 1 with tBuNC in the presence of 1,3,5,7-cyclooctatetraene led to formal nitrene group transfer and the formation of the Ti(II) species [Ti(COT)(¦Ç4-C8H8)] (13) and tBuNCNtBu. The analogous reactions between 2 and 3 and tBuNC gave [Ti(NtBu)(COT”)(CNtBu)] (15) and [Ti(NAr)(COT)(CNtBu)] (17), and similarly the reaction between 1 and pyridine gave [Ti(NtBu)(COT)(py)] (19) (py = pyridine). Complex 19 was crystallog. characterized. DFT studies indicated that the interaction between pyridine and the Ti center in 19 and tBuNC and the Ti center in 17 was electrostatic in nature. [Ti(NR)(COT)(AlMe3-xClx)] (R = tBu, x = 0 (20); R = Ar, x = 0 (21); R = tBu, x = 1 (22); R = Ar, x = 1 (23)) were formed through the reactions of 1 and 3 with AlMe3 and AlMe2Cl, and DFT studies indicated that they contained four-membered metallacyclic rings. Attempts to prepare monomeric Zr imido cyclooctatetraene complexes through the reactions of [Zr2(¦Ì-NR)2Cl4(THF)x] (R = tBu, x = 3; R = 2,6-Me2C6H3(Ar’), x = 4) with K2COT, Li2COT”¡¤1.8(THF), or Li2[COT*] (COT* = 1,4-C8H6(SiMe2tBu)2) were unsuccessful. Only the crystallog. characterized dimeric species [Zr2(¦Ì-NAr’)2(COT”)2] (24) was isolated.

Organometallics published new progress about 22693-41-0. 22693-41-0 belongs to catalysis-chemistry, auxiliary class Other Functionalization Reagent, name is 2,4,6-Triisopropylbenzenethiol, and the molecular formula is C15H24S, Recommanded Product: 2,4,6-Triisopropylbenzenethiol.

Referemce:
https://courses.lumenlearning.com/boundless-chemistry/chapter/catalysis/,
Catalysis – Wikipedia

Bai, Yajun’s team published research in European Journal of Medicinal Chemistry in 183 | CAS: 16909-09-4

European Journal of Medicinal Chemistry published new progress about 16909-09-4. 16909-09-4 belongs to catalysis-chemistry, auxiliary class Alkenyl,Carboxylic acid,Benzene,Ether, name is (E)-3-(2,4-Dimethoxyphenyl)acrylic acid, and the molecular formula is C11H12O4, Synthetic Route of 16909-09-4.

Bai, Yajun published the artcilePolygala tenuifolia-Acori tatarinowii herbal pair as an inspiration for substituted cinnamic ¦Á-asaronol esters: Design, synthesis, anticonvulsant activity, and inhibition of lactate dehydrogenase study, Synthetic Route of 16909-09-4, the publication is European Journal of Medicinal Chemistry (2019), 111650, database is CAplus and MEDLINE.

Inspired by the traditional Chinese herbal pair of Polygala tenuifolia-Acori Tatarinowii for treating epilepsy, 33 novel substituted cinnamic ¦Á-asaronol esters and analogs, I [R = 2-, 3-, 4-OMe, 2,3-(MeO)2, 2,3,5-(MeO)3, 2,3,4,5,6-(MeO)5, 4-Br, 3-CF3, etc.], II, III, and IV, were designed by Combination of Traditional Chinese Medicine Mol. Chem. (CTCMMC) strategy, synthesized and tested systematically not only for anticonvulsant activity in three mouse models but also for lactate dehydrogenase (LDH) inhibitory activity. Thus, compounds I [R = 3,4,5-(MeO)3, 2,3,4,5-(MeO)4, 2,3,4,6-(MeO)4, 4-F] (V) displayed excellent and broad spectra of anticonvulsant activities with modest ability in preventing neuropathic pain, as well as low neurotoxicity. The protective indexes of these four compounds compared favorably with stiripentol, lacosamide, carbamazepine and valproic acid. 68-70 exhibited good LDH1 and LDH5 inhibitory activities with noncompetitive inhibition type, and were more potent than stiripentol. Compounds V exhibited good LDH1 and LDH5 inhibitory activities with noncompetitive inhibition type, and were more potent than stiripentol. Notably, I [R = 2,3,4,6-(MeO)4], as a representative agent, was also shown as a moderately pos. allosteric modulator at human ¦Á1¦Â2¦Ã2 GABAA receptors (EC50 46.3 ¡À 7.3 ¦ÌM). Thus, I [R = 3,4,5-(MeO)3, 2,3,4,5-(MeO)4, 2,3,4,6-(MeO)4] were promising candidates for developing into anti-epileptic drugs, especially for treatment of refractory epilepsies such as Dravet syndrome.

European Journal of Medicinal Chemistry published new progress about 16909-09-4. 16909-09-4 belongs to catalysis-chemistry, auxiliary class Alkenyl,Carboxylic acid,Benzene,Ether, name is (E)-3-(2,4-Dimethoxyphenyl)acrylic acid, and the molecular formula is C11H12O4, Synthetic Route of 16909-09-4.

Referemce:
https://courses.lumenlearning.com/boundless-chemistry/chapter/catalysis/,
Catalysis – Wikipedia

Taghiof, Majid’s team published research in Organometallics in 14 | CAS: 22693-41-0

Organometallics published new progress about 22693-41-0. 22693-41-0 belongs to catalysis-chemistry, auxiliary class Other Functionalization Reagent, name is 2,4,6-Triisopropylbenzenethiol, and the molecular formula is C11H10O, Synthetic Route of 22693-41-0.

Taghiof, Majid published the artcileOrganoaluminum and -gallium Thiolates. 1. Synthetic and X-ray Structural Studies, Synthetic Route of 22693-41-0, the publication is Organometallics (1995), 14(6), 2903-17, database is CAplus.

Organoaluminum and -Ga thiolates were prepared in high yield by the reaction of triorganoaluminum and -Ga derivatives with thiols. In this way, [Mes2Al(¦Ì-SBz)]2 (Mes = 2,4,6-Me3C6H2; Bz = CH2Ph) (1), [Me2Al(¦Ì-SSiPh3)]2 (2), [Mes2Al(¦Ì-SPh)]2 (3), {Me2Al[¦Ì-S(2-t-BuC6H4)]}3 (4), {Me2Al[¦Ì-S(2-Me3Si)C6H4]}3 (5), {Me2Al[¦Ì-S(2-i-PrC6H4)]}3 (6), {i-Bu2Al[¦Ì-S(2,4,6-i-Pr3C6H2)]}3 (7), {Me2Al[¦Ì-S(2,6-Me2C6H3)]}4 (8), and {Me2Ga[¦Ì-S(2,6-Me2C6H3)]}4 (9) were prepared and crystallog. characterized. The dimethyl- and dimesitylaluminum thiolates 13 are dimeric with four-membered (AlS)2 rings. The structure of 1 was determined in space group P21/n (Number 14): a 10.660(4), b 12.268(2), c 17.793(3) ?, ¦Â 106.94(2)¡ã, Z = 4, R = 6.7%, and Rw = 6.1%. The structures of 2 and 3 were determined in space group P1? (Number 2): a 9.077(2), b 13.847(3), c 16.724(4) ?, ¦Á 101.08(2), ¦Â 95.34(2), ¦Ã 103.38(2)¡ã, Z = 2 (dimers), R = 5.2%, and Rw = 5.1% for 2, and a 11.068(5), b 12.470(3), c 17.654(5) ?, ¦Á 90.97(2), ¦Â 107.77(3), ¦Ã 112.23(3)¡ã, Z = 4, R = 5.9%, and Rw = 4.8% for 3. The dialkylaluminum thiolates, 47, are trimeric in the solid state. The structure of 4 was determined in space group P21/c, a 9.324(7), b 18.632(5), c 23.959(9) ?, ¦Â 98.31(5)¡ã, Z = 4 (trimers), R = 7.6%, and Rw = 5.2%; 5 in space group P1?, a 10.149(4), b 14.427(5), c 15.159(4) ?, ¦Á 88.19(3), ¦Â 89.39(3), ¦Ã 88.57(3)¡ã, Z = 2 (trimers), R = 5.0%, and Rw = 5.0%; 6 in space group P1?, a 12.538(5), b 13.180(2), c 13.873(2) ?, ¦Á 74.38(1), ¦Â 64.18(2), ¦Ã 69.44(2)¡ã, Z = 2 (trimers), R = 5.2% and Rw = 4.4%; and 7 in space group P21/c, a 13.935(2), b 22.563(4), c 25.044(4) ?, ¦Â 101.44(1)¡ã, Z = 4 (trimers), R = 12.5%, and Rw = 14.2%. The S atoms in 7 are in a planar environment. Compounds 8 and 9 are tetrameric with eight-membered (MS)4 (M = Al, Ga) ring systems. They are isomorphous, and their structures were determined in space group P1?. For 8 a 8.555(1), b 11.869(1), c 12.688(1) ?, ¦Á 96.546(8), ¦Â 106.34(1), ¦Ã 109.06(1)¡ã, Z = 2, R = 5.0%, and Rw = 5.2%, and for 9 a 8.525(2), b 11.805(3), c 12.714(4) ?, ¦Á 96.36(2), ¦Â 106.46(2), ¦Ã 108.90(2)¡ã, Z = 2, R = 6.1%, and Rw = 6.6%.

Organometallics published new progress about 22693-41-0. 22693-41-0 belongs to catalysis-chemistry, auxiliary class Other Functionalization Reagent, name is 2,4,6-Triisopropylbenzenethiol, and the molecular formula is C11H10O, Synthetic Route of 22693-41-0.

Referemce:
https://courses.lumenlearning.com/boundless-chemistry/chapter/catalysis/,
Catalysis – Wikipedia

Musdal, Yaman’s team published research in Chemico-Biological Interactions in 205 | CAS: 38260-01-4

Chemico-Biological Interactions published new progress about 38260-01-4. 38260-01-4 belongs to catalysis-chemistry, auxiliary class Chelating Agents, name is N1,N1′-(Ethane-1,2-diyl)bis(ethane-1,2-diamine) dihydrochloride, and the molecular formula is C6H20Cl2N4, Application In Synthesis of 38260-01-4.

Musdal, Yaman published the artcileFDA-approved drugs and other compounds tested as inhibitors of human glutathione transferase P1-1, Application In Synthesis of 38260-01-4, the publication is Chemico-Biological Interactions (2013), 205(1), 53-62, database is CAplus and MEDLINE.

Glutathione transferase P1-1 (GST P1-1) is often overexpressed in tumor cells and is regarded as a contributor to their drug resistance. Inhibitors of GST P1-1 are expected to counteract drug resistance and may therefore serve as adjuvants in the chemotherapy of cancer by increasing the efficacy of cytostatic drugs. Finding useful inhibitors among compounds used for other indications would be a shortcut to clin. applications and a search for GST P1-1 inhibitors among approved drugs and other compounds was therefore conducted. We tested 1040 FDA-approved compounds as inhibitors of the catalytic activity of purified human GST P1-1 in vitro. We identified chlorophyllide, merbromine, hexachlorophene, and ethacrynic acid as the most effective GST P1-1 inhibitors with IC50 values in the low micromolar range. For comparison, these compounds were even more potent in the inhibition of human GST A3-3, an enzyme implicated in steroid hormone biosynthesis. In distinction from the other inhibitors, which showed conventional inhibition patterns, the competitive inhibitor ethacrynic acid elicited strong kinetic cooperativity in the glutathione saturation of GST P1-1. Apparently, ethacrynic acid serves as an allosteric inhibitor of the enzyme. In their own right, the compounds investigated are less potent than desired for adjuvants in cancer chemotherapy, but the structures of the most potent inhibitors could serve as leads for the synthesis of more efficient adjuvants.

Chemico-Biological Interactions published new progress about 38260-01-4. 38260-01-4 belongs to catalysis-chemistry, auxiliary class Chelating Agents, name is N1,N1′-(Ethane-1,2-diyl)bis(ethane-1,2-diamine) dihydrochloride, and the molecular formula is C6H20Cl2N4, Application In Synthesis of 38260-01-4.

Referemce:
https://courses.lumenlearning.com/boundless-chemistry/chapter/catalysis/,
Catalysis – Wikipedia