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

Structure

InChI Key OWFINXQLBMJDJQ-UHFFFAOYSA-N
Smiles Clc1ccc2cc3ccccc3cc2c1
InChI
InChI=1S/C14H9Cl/c15-14-6-5-12-7-10-3-1-2-4-11(10)8-13(12)9-14/h1-9H

Physicochemical Descriptors

Property Name Value
Molecular Formula C14H9Cl1
Molecular Weight 212.04
AlogP 4.65
Heavy Atoms 15.0

Cross References

Resources Reference
CAS NUMBER 17135-78-3
NORMAN SUSDAT