Pubchem ID | 61634 |
---|---|
CAS | 8028-89-5 |
IUPAC name | 3,5-dimethylcyclopentane-1,2-dione |
Synonyms | 3,5-Dimethyl-1,2-cyclopentanedione|3,5-Dimethyl-1,2-cyclopentadione|3,5-Dimethylcyclopentane-1,2-dione|1,2-Cyclopentanedione, 3,5-dimethyl-|W-108275|FEMA No. 3269 |
Categories | Color |
SMILES | CC1CC(C(=O)C1=O)C |
InCheykey | InChI=1S/C7H10O2/c1-4-3-5(2)7(9)6(4)8/h4-5H,3H2,1-2H3 |
Natural | nan |
E No. | E150 |
GHS Siginal | Warning |
ADI Value | - |
Molecular weight | Hydrogen Bond Donor count | Hydrogen Bond Acceptor count | Rotatable bonds | Topological Polor Surface Area |
---|---|---|---|---|
126.155 | 0 | 2 | 0 | 34.1 |
Human Intestinal Absorption | Aqueous Solubility Level | Plasma Protein Binding Level | Blood Brain Barrier Penetration | CYP2DE Binding Level | Hepatotoxicity Level |
---|---|---|---|---|---|
Good Absorption | Optimal Solubility | Binder | Medium | Non - Inhibitor | Toxic |
Carcinogenicity | Developmental Toxicity | Mutagenicity (Ames) | Skin Irritancy | Skin Sensitization | Ocular Irritancy | Aerobic Biodegradability |
---|---|---|---|---|---|---|
Carcinogen | Toxic | Non-Mutagen | Irritant | Irritant | Irritant | Degradable |