Pubchem ID | 8797 |
---|---|
CAS | 140-39-6 |
IUPAC name | (4-methylphenyl) acetate |
Synonyms | p-Cresyl acetate|4-Tolyl acetate|Acetic acid, 4-methylphenyl ester|4-Methylphenyl acetate|p-Acetoxytoluene|p-Cresol acetate|4-Acetoxytoluene|Narceol|Cresyl acetate|p-Tolyl ethanoate|Paracresyl acetate|Acetic acid, p-tolyl ester |
Categories | Flavor enhancer |
SMILES | CC1=CC=C(C=C1)OC(=O)C |
InCheykey | InChI=1S/C9H10O2/c1-7-3-5-9(6-4-7)11-8(2)10/h3-6H,1-2H3 |
Natural | YES |
E No. | - |
GHS Siginal | - |
ADI Value | - |
Molecular weight | Hydrogen Bond Donor count | Hydrogen Bond Acceptor count | Rotatable bonds | Topological Polor Surface Area |
---|---|---|---|---|
150.177 | 0 | 2 | 2 | 26.3 |
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 | Toxic |
Carcinogenicity | Developmental Toxicity | Mutagenicity (Ames) | Skin Irritancy | Skin Sensitization | Ocular Irritancy | Aerobic Biodegradability |
---|---|---|---|---|---|---|
Non-Carcinogen | Non-Toxic | Non-Mutagen | Irritant | Irritant | Irritant | Degradable |