Keyword(s): Human Metabolites
Molecule Category Free-form
UNII NP52UM3ECS
EPA CompTox DTXSID40161745

Structure

InChI Key RRBZUCWNYQUCTR-UHFFFAOYSA-N
Smiles NNCC(=O)O
InChI
InChI=1S/C2H6N2O2/c3-4-1-2(5)6/h4H,1,3H2,(H,5,6)

Physicochemical Descriptors

Property Name Value
Molecular Formula C2H6N2O2
Molecular Weight 90.04
AlogP -1.47
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 2.0
Polar Surface Area 75.35
Heavy Atoms 6.0

Cross References

Resources Reference
CAS NUMBER 14150-64-2
NORMAN SUSDAT
FDA SRS NP52UM3ECS
ChemSpider 75984.0