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:T04
Name:Methyl-2,2,2-trinitro-ethylnitroamine
Description:
Labels:
CAS:71081-38-4
InChi Code:InChI=1S/C3H5N5O8/c1-4(8(15)16)2-3(5(9)10,6(11)12)7(13)14/h2H2,1H3

Properties

log_h50%: Impact sensitivity [cm]

ValueSource or prediction
0.95

experimental value

1

Eq6: Model for nitramines (Training set)