Pubchem ID | 14511 |
---|---|
CAS | 1193-18-6 |
IUPAC name | 3-methylcyclohex-2-en-1-one |
Synonyms | 3-Methylcyclohex-2-en-1-one|3-Methyl-2-cyclohexenone|Seudenone|2-Cyclohexen-1-one, 3-methyl-|Methylcyclohexenone |
Categories | Flavor enhancer |
SMILES | CC1=CC(=O)CCC1 |
InCheykey | InChI=1S/C7H10O/c1-6-3-2-4-7(8)5-6/h5H,2-4H2,1H3 |
Natural | YES |
E No. | - |
GHS Siginal | - |
ADI Value | - |
Molecular weight | Hydrogen Bond Donor count | Hydrogen Bond Acceptor count | Rotatable bonds | Topological Polor Surface Area |
---|---|---|---|---|
110.156 | 0 | 1 | 0 | 17.1 |
Human Intestinal Absorption | Aqueous Solubility Level | Plasma Protein Binding Level | Blood Brain Barrier Penetration | CYP2DE Binding Level | Hepatotoxicity Level |
---|---|---|---|---|---|
Good Absorption | Slightly Soluble | Binder | High | Non - Inhibitor | Non Toxic |
Carcinogenicity | Developmental Toxicity | Mutagenicity (Ames) | Skin Irritancy | Skin Sensitization | Ocular Irritancy | Aerobic Biodegradability |
---|---|---|---|---|---|---|
Carcinogen | Toxic | Non-Mutagen | Irritant | Irritant | Irritant | Degradable |