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:T06
Name:N-methyl-N,N'-dinitro-1,2-ethanediamine
Description:
Labels:
CAS:10308-90-4
InChi Code:InChI=1S/C3H8N4O4/c1-5(7(10)11)3-2-4-6(8)9/h4H,2-3H2,1H3

Properties

log_h50%: Impact sensitivity [cm]

ValueSource or prediction
2.06

experimental value

1.93

Eq6: Model for nitramines (Training set)