Keyword(s): Human Metabolites
Molecule Category Free-form

Structure

InChI Key SWZVJOLLQTWFCW-UHFFFAOYSA-N
Smiles ClC=1C(O)=CC=CC1O
InChI
InChI=1/C6H5ClO2/c7-6-4(8)2-1-3-5(6)9/h1-3,8-9H

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H5ClO2
Molecular Weight 144.0
AlogP 1.75
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 2.0
Polar Surface Area 40.46
Heavy Atoms 9.0

Cross References

Resources Reference
CAS NUMBER 6201-65-6
NORMAN SUSDAT
PubChem 80331