Structure

InChI Key AMIMRNSIRUDHCM-UHFFFAOYSA-N
Smiles CC(C)C=O
InChI
InChI=1S/C4H8O/c1-4(2)3-5/h3-4H,1-2H3

Physicochemical Descriptors

Property Name Value
Molecular Formula C4H8O1
Molecular Weight 72.06
AlogP 0.84
Hydrogen Bond Acceptor 1.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 1.0
Polar Surface Area 17.07
Molecular species None
Aromatic Rings 0.0
Heavy Atoms 5.0

Cross References

Resources Reference
CAS NUMBER 78-84-2
NORMAN SUSDAT
FDA SRS C42E28168L
PubChem 6561
ChemSpider 6313.0