Keyword(s): Human Metabolites
Molecule Category Free-form
UNII 0W5I7B2C2H
EPA CompTox DTXSID20211550

Structure

InChI Key AVWRKZWQTYIKIY-UHFFFAOYSA-N
Smiles NC(=O)NC(O)=O
InChI
InChI=1S/C2H4N2O3/c3-1(5)4-2(6)7/h(H,6,7)(H3,3,4,5)

Physicochemical Descriptors

Property Name Value
Molecular Formula C2H4N2O3
Molecular Weight 104.02
AlogP -0.25
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 4.0
Polar Surface Area 93.41
Heavy Atoms 7.0

Cross References

Resources Reference
CAS NUMBER 625-78-5
NORMAN SUSDAT
FDA SRS 0W5I7B2C2H
PubChem 20286801
ChemSpider 132943.0