Pubchem ID | 5282110 |
---|---|
CAS | 103-54-8 |
IUPAC name | [(E)-3-phenylprop-2-enyl] acetate |
Synonyms | 3-Phenylallyl acetate|3-Phenyl-2-propenyl acetate|(E)-Cinnamyl acetate|trans-Cinnamyl acetate|FEMA No. 2293 |
Categories | Flavor enhancer |
SMILES | CC(=O)OCC=CC1=CC=CC=C1 |
InCheykey | InChI=1S/C11H12O2/c1-10(12)13-9-5-8-11-6-3-2-4-7-11/h2-8H,9H2,1H3/b8-5+ |
Natural | YES |
E No. | - |
GHS Siginal | - |
ADI Value | - |
Molecular weight | Hydrogen Bond Donor count | Hydrogen Bond Acceptor count | Rotatable bonds | Topological Polor Surface Area |
---|---|---|---|---|
176.215 | 0 | 2 | 4 | 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 | Non Toxic |
Carcinogenicity | Developmental Toxicity | Mutagenicity (Ames) | Skin Irritancy | Skin Sensitization | Ocular Irritancy | Aerobic Biodegradability |
---|---|---|---|---|---|---|
Carcinogen | Non-Toxic | Non-Mutagen | Irritant | Irritant | Non-Irritant | Degradable |