Structure

InChI Key YRIZYWQGELRKNT-UHFFFAOYSA-N
Smiles Cln1c(=O)n(Cl)c(=O)n(Cl)c1=O
InChI
InChI=1S/C3Cl3N3O3/c4-7-1(10)8(5)3(12)9(6)2(7)11

Physicochemical Descriptors

Property Name Value
Molecular Formula C3Cl3N3O3
Molecular Weight 230.9
AlogP -0.82
Hydrogen Bond Acceptor 6.0
Polar Surface Area 66.0
Heavy Atoms 12.0

Cross References

Resources Reference
CAS NUMBER 87-90-1
NORMAN SUSDAT
FDA SRS RL3HK1I66B
PubChem 6909
ChemSpider 6643.0