Structure

InChI Key DCXYFEDJOCDNAF-REOHCLBHSA-N
Smiles N[C@@H](CC(N)=O)C(O)=O
InChI
InChI=1S/C4H8N2O3/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H2,6,7)(H,8,9)/t2-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C4H8N2O3
Molecular Weight 132.05
AlogP -0.68
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 4.0
Number of Rotational Bond 3.0
Polar Surface Area 107.4
Heavy Atoms 9.0

Cross References

Resources Reference
CAS NUMBER 70-47-3
NORMAN SUSDAT
FDA SRS 5Z33R5TKO7
PubChem 6267
ChemSpider 6031.0