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

Structure

InChI Key AJCSNHQKXUSMMY-UHFFFAOYSA-N
Smiles Fc1ccc(Cl)c(F)c1
InChI
InChI=1S/C6H3ClF2/c7-5-2-1-4(8)3-6(5)9/h1-3H

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H3Cl1F2
Molecular Weight 147.99
AlogP 2.62
Heavy Atoms 9.0

Cross References

Resources Reference
CAS NUMBER 1435-44-5
NORMAN SUSDAT