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

Structure

InChI Key QUBJDMPBDURTJT-UHFFFAOYSA-N
Smiles Clc1cscc1
InChI
InChI=1S/C4H3ClS/c5-4-1-2-6-3-4/h1-3H

Physicochemical Descriptors

Property Name Value
Molecular Formula C4H3Cl1S1
Molecular Weight 117.96
AlogP 2.4
Hydrogen Bond Acceptor 1.0
Heavy Atoms 6.0

Cross References

Resources Reference
CAS NUMBER 17249-80-8
NORMAN SUSDAT