Keyword(s): Human Metabolites
Molecule Category Free-form
UNII FE96J4NEA6
EPA CompTox DTXSID9061596

Structure

InChI Key XACWJIQLDLUFSR-UHFFFAOYSA-N
Smiles O=C(Cl)N1CCCC1
InChI
InChI=1/C5H8ClNO/c6-5(8)7-3-1-2-4-7/h1-4H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C5H8ClNO
Molecular Weight 133.03
AlogP 1.44
Hydrogen Bond Acceptor 1.0
Polar Surface Area 20.31
Heavy Atoms 8.0

Cross References

Resources Reference
CAS NUMBER 1192-63-8
NORMAN SUSDAT
FDA SRS FE96J4NEA6
PubChem 70937