| Pubchem ID | 6378 |
|---|---|
| CAS | 75-56-9 |
| IUPAC name | 2-methyloxirane |
| Synonyms | 2-Methyloxirane|1,2-Epoxypropane|Methyloxirane|Propyleneoxide|Epoxypropane|Oxirane, methyl-|Propene oxide |
| Categories | Not Categorized |
| SMILES | CC1CO1 |
| InCheykey | InChI=1S/C3H6O/c1-3-2-4-3/h3H,2H2,1H3 |
| Natural | nan |
| E No. | - |
| GHS Siginal | - |
| ADI Value | - |
Physicochemical Properties
| Molecular weight | Hydrogen Bond Donor count | Hydrogen Bond Acceptor count | Rotatable bonds | Topological Polor Surface Area |
|---|---|---|---|---|
| 58.08 | 0 | 1 | 0 | 12.5 |
ADME Predicted Parameters
| Human Intestinal Absorption | Aqueous Solubility Level | Plasma Protein Binding Level | Blood Brain Barrier Penetration | CYP2DE Binding Level | Hepatotoxicity Level |
|---|---|---|---|---|---|
| Low Absorption | Optimal Solubility | Weaker / Non binder | Undefined | Non - Inhibitor | Toxic |
Toxicity Predicted Parameters
| Carcinogenicity | Developmental Toxicity | Mutagenicity (Ames) | Skin Irritancy | Skin Sensitization | Ocular Irritancy | Aerobic Biodegradability |
|---|---|---|---|---|---|---|
| Carcinogen | Non-Toxic | Non-Mutagen | Irritant | Non-Irritant | Irritant | Degradable |