Structure

InChI Key WHUUTDBJXJRKMK-VKHMYHEASA-N
Smiles C(CC(=O)O)[C@@H](C(=O)O)N
InChI
InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1

Physicochemical Descriptors

Property Name Value
Molecular Formula C5H9NO4
Molecular Weight 147.05
AlogP -0.74
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 3.0
Number of Rotational Bond 4.0
Polar Surface Area 100.62
Heavy Atoms 10.0

Cross References

Resources Reference
CAS NUMBER 56-86-0
NORMAN SUSDAT
FDA SRS 3KX376GY7L
PubChem 33032
ChemSpider 30572.0