Pubchem ID | 19089 |
---|---|
CAS | 3558-60-9 |
IUPAC name | 2-methoxyethylbenzene |
Synonyms | (2-Methoxyethyl)benzene|Methyl phenethyl ether|2-Phenylethyl methyl ether|2-methoxyethylbenzene|Benzene, (2-methoxyethyl)-|Methyl phenylethyl ether|Phenylethyl methyl ether|Kewda ether|Methyl phenethyl oxide|Methyl 2-phenethyl ether|Kedwa ether|1-Methoxy-2-phenylethane|Phenethyl methyl ether|2-Phenethyl methyl ether |
Categories | Flavor enhancer |
SMILES | COCCC1=CC=CC=C1 |
InCheykey | InChI=1S/C9H12O/c1-10-8-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3 |
Natural | YES |
E No. | - |
GHS Siginal | - |
ADI Value | - |
Molecular weight | Hydrogen Bond Donor count | Hydrogen Bond Acceptor count | Rotatable bonds | Topological Polor Surface Area |
---|---|---|---|---|
136.194 | 0 | 1 | 3 | 9.2 |
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 |
---|---|---|---|---|---|---|
Non-Carcinogen | Toxic | Non-Mutagen | Irritant | Irritant | Irritant | Non-Degradable |