Gharagheizi, Farhad published the artcileA New Neural Network Group Contribution Method for Estimation of Upper Flash Point of Pure Chemicals, COA of Formula: C12H9N3O4, the publication is Industrial & Engineering Chemistry Research (2010), 49(24), 12685-12695, database is CAplus.
A new group contribution-based models is presented to predict the upper flash point temperature of pure compounds based on a large dataset (1294). This neural network model uses several occurrences of 122 chem. groups in a pure compound to predict its related upper flash point limit. The model squared correlation coefficient, average percent error, mean average error, and root-mean-square error over the main dataset (1294 pure compounds) were 0.99, 1.7%, 6, and 8.5, resp.
Industrial & Engineering Chemistry Research published new progress about 1821-27-8. 1821-27-8 belongs to catalysis-chemistry, auxiliary class Nitro Compound,Amine,Benzene, name is Bis(4-nitrophenyl)amine, and the molecular formula is C12H9N3O4, COA of Formula: C12H9N3O4.
Referemce:
https://courses.lumenlearning.com/boundless-chemistry/chapter/catalysis/,
Catalysis – Wikipedia