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:V04
Name:Trinitroethyl-N-ethyl-N-nitro-carbamate
Description:
Labels:
CAS:
InChi Code:InChI=1S/C5H7N5O10/c1-2-6(10(18)19)4(11)20-3-5(7(12)13,8(14)15)9(16)17/h2-3H2,1H3

Properties

log_h50%: Impact sensitivity [cm]

ValueSource or prediction
1.28

experimental value

1.48

Eq6: Model for nitramines (Test set)