Keyword(s): Human Metabolites
Molecule Category Salt-form
UNII 52C2DIA291
EPA CompTox DTXSID80932890

Structure

InChI Key LGRQUXHYJBFGTM-UHFFFAOYSA-N
Smiles [Cl-].[NH2+]1C=CN=C1
InChI
InChI=1S/C3H4N2/c1-2-5-3-4-1/h1,3H,2H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C3H4N2
Molecular Weight 68.04
AlogP 0.1
Hydrogen Bond Acceptor 2.0
Polar Surface Area 24.72
Heavy Atoms 5.0

Cross References

Resources Reference
CAS NUMBER 1467-16-9
NORMAN SUSDAT
FDA SRS 52C2DIA291