Structure

InChI Key RMIODHQZRUFFFF-UHFFFAOYSA-N
Smiles COCC(O)=O
InChI
InChI=1S/C3H6O3/c1-6-2-3(4)5/h2H2,1H3,(H,4,5)

Physicochemical Descriptors

Property Name Value
Molecular Formula C3H6O3
Molecular Weight 90.03
AlogP -0.28
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 2.0
Polar Surface Area 46.53
Heavy Atoms 6.0

Cross References

Resources Reference
CAS NUMBER 625-45-6
NORMAN SUSDAT
FDA SRS F11T1H7Q7W
PubChem 12251
ChemSpider 11750.0