10967/231 - QDB Compounds

QsarDB Repository

Fayet, G.; Rotureau, P. Development of simple QSPR models for the impact sensitivity of nitramines. J. Loss Prev. Process Ind. 2014, 30, 1–8.

Compound

ID:V01
Name:Cyclotrimethylenetrinitramine
Description:
Labels:
CAS:121-82-4
InChi Code:InChI=1S/C3H6N6O6/c10-7(11)4-1-5(8(12)13)3-6(2-4)9(14)15/h1-3H2

Properties

log_h50%: Impact sensitivity [cm]

ValueSource or prediction
1.41

experimental value

1.31

Eq6: Model for nitramines (Test set)