Pubchem ID | 73885 |
---|---|
CAS | 1489-57-2 |
IUPAC name | 2-methylcyclohexa-1,3-diene |
Synonyms | 2-Methyl-1,3-cyclohexadiene|4,5-Dihydrotoluene|1,3-Cyclohexadiene, 2-methyl- |
Categories | Flavor enhancer |
SMILES | CC1=CCCC=C1 |
InCheykey | InChI=1S/C7H10/c1-7-5-3-2-4-6-7/h3,5-6H,2,4H2,1H3 |
Natural | nan |
E No. | - |
GHS Siginal | - |
ADI Value | - |
Molecular weight | Hydrogen Bond Donor count | Hydrogen Bond Acceptor count | Rotatable bonds | Topological Polor Surface Area |
---|---|---|---|---|
94.157 | 0 | 0 | 0 | 0.0 |
Human Intestinal Absorption | Aqueous Solubility Level | Plasma Protein Binding Level | Blood Brain Barrier Penetration | CYP2DE Binding Level | Hepatotoxicity Level |
---|---|---|---|---|---|
Moderate 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 |