Pubchem ID | 180 |
---|---|
CAS | 67-64-1 |
IUPAC name | propan-2-one |
Synonyms | 2-propanone|propanone|Dimethyl ketone|propan-2-one|Methyl ketone|Pyroacetic ether|Dimethylformaldehyde|beta-Ketopropane|Dimethylketal|Chevron acetone|Ketone propane|Aceton|Pyroacetic acid|Ketone, dimethyl|dimethylketone|Acetone |
Categories | Flavor enhancer |
SMILES | CC(=O)C |
InCheykey | InChI=1S/C3H6O/c1-3(2)4/h1-2H3 |
Natural | YES |
E No. | - |
GHS Siginal | Danger |
ADI Value | - |
Molecular weight | Hydrogen Bond Donor count | Hydrogen Bond Acceptor count | Rotatable bonds | Topological Polor Surface Area |
---|---|---|---|---|
58.08 | 0 | 1 | 0 | 17.1 |
Human Intestinal Absorption | Aqueous Solubility Level | Plasma Protein Binding Level | Blood Brain Barrier Penetration | CYP2DE Binding Level | Hepatotoxicity Level |
---|---|---|---|---|---|
Moderate Absorption | Optimal Solubility | Weaker / Non binder | Undefined | Non - Inhibitor | Toxic |
Carcinogenicity | Developmental Toxicity | Mutagenicity (Ames) | Skin Irritancy | Skin Sensitization | Ocular Irritancy | Aerobic Biodegradability |
---|---|---|---|---|---|---|
Carcinogen | Toxic | Non-Mutagen | Irritant | Irritant | Irritant | Degradable |