Structure

InChI Key BFCFYVKQTRLZHA-UHFFFAOYSA-N
Smiles [O-][N+](=O)c1ccccc1Cl
InChI
InChI=1S/C6H4ClNO2/c7-5-3-1-2-4-6(5)8(9)10/h1-4H

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H4Cl1N1O2
Molecular Weight 156.99
AlogP 2.25
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 1.0
Polar Surface Area 43.14
Heavy Atoms 10.0

Cross References

Resources Reference
CAS NUMBER 88-73-3
NORMAN SUSDAT
FDA SRS D1YI9R2K8O
PubChem 6945
ChemSpider 13853953.0