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:T17
Name:N,N'-3,3-tetranitro-1,5-pentanediamine
Description:
Labels:
CAS:71706-06-4
InChi Code:InChI=1S/C5H10N6O8/c12-8(13)5(9(14)15,1-3-6-10(16)17)2-4-7-11(18)19/h6-7H,1-4H2

Properties

log_h50%: Impact sensitivity [cm]

ValueSource or prediction
1.54

experimental value

1.61

Eq6: Model for nitramines (Training set)