Keyword(s): Human Metabolites
Molecule Category Free-form
UNII W3R75W7BP5
EPA CompTox DTXSID30173059

Structure

InChI Key FCWAYYDINOPRFJ-UHFFFAOYSA-N
Smiles ClN1CCCCCC1=O
InChI
InChI=1S/C6H10ClNO/c7-8-5-3-1-2-4-6(8)9/h1-5H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C6H10Cl1N1O1
Molecular Weight 147.05
AlogP 1.54
Hydrogen Bond Acceptor 1.0
Polar Surface Area 20.31
Heavy Atoms 9.0

Cross References

Resources Reference
CAS NUMBER 19434-64-1
NORMAN SUSDAT
FDA SRS W3R75W7BP5
PubChem 88061
ChemSpider 79446.0