Keyword(s): Human Metabolites
Molecule Category Free-form
UNII AO0886WFZU
EPA CompTox DTXSID3060035

Structure

InChI Key OTIXUSNHAKOJBX-UHFFFAOYSA-N
Smiles CC(=O)N1CC1
InChI
InChI=1S/C4H7NO/c1-4(6)5-2-3-5/h2-3H2,1H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C4H7N1O1
Molecular Weight 85.05
AlogP -0.15
Hydrogen Bond Acceptor 1.0
Polar Surface Area 20.08
Heavy Atoms 6.0

Cross References

Resources Reference
CAS NUMBER 460-07-1
NORMAN SUSDAT
FDA SRS AO0886WFZU
PubChem 9994
ChemSpider 9600.0