Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 6P25IPQ8GN
EPA CompTox DTXSID9025116

Structure

InChI Key OAGOUCJGXNLJNL-UHFFFAOYSA-N
Smiles CN(C)C#N
InChI
InChI=1S/C3H6N2/c1-5(2)3-4/h1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C3H6N2
Molecular Weight 70.05
AlogP 0.03
Hydrogen Bond Acceptor 2.0
Polar Surface Area 27.03
Heavy Atoms 5.0

Cross References

Resources Reference
CAS NUMBER 1467-79-4
NORMAN SUSDAT
FDA SRS 6P25IPQ8GN
PubChem 15112
ChemSpider 14384.0