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:V10
Name:Bis-(trinitroethyl)-2,4-dinitrazapentanedioate
Description:
Labels:
CAS:
InChi Code:InChI=1S/C7H6N10O20/c18-4(36-1-6(10(20)21,11(22)23)12(24)25)8(16(32)33)3-9(17(34)35)5(19)37-2-7(13(26)27,14(28)29)15(30)31/h1-3H2

Properties

log_h50%: Impact sensitivity [cm]

ValueSource or prediction
1

experimental value

0.96

Eq6: Model for nitramines (Test set)