| Pubchem ID | 74201 |
|---|---|
| CAS | 1628-89-3 |
| IUPAC name | 2-methoxypyridine |
| Synonyms | Pyridine, 2-methoxy-|2-methoxy-pyridine|2-Methoxy pyridine|Pyridine, methoxy- |
| Categories | Flavor enhancer |
| SMILES | COC1=CC=CC=N1 |
| InCheykey | InChI=1S/C6H7NO/c1-8-6-4-2-3-5-7-6/h2-5H,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 |
|---|---|---|---|---|
| 109.128 | 0 | 2 | 1 | 22.1 |
ADME Predicted Parameters
| Human Intestinal Absorption | Aqueous Solubility Level | Plasma Protein Binding Level | Blood Brain Barrier Penetration | CYP2DE Binding Level | Hepatotoxicity Level |
|---|---|---|---|---|---|
| Good Absorption | Optimal Solubility | Weaker / Non binder | Medium | Non - Inhibitor | Toxic |
Toxicity Predicted Parameters
| Carcinogenicity | Developmental Toxicity | Mutagenicity (Ames) | Skin Irritancy | Skin Sensitization | Ocular Irritancy | Aerobic Biodegradability |
|---|---|---|---|---|---|---|
| Carcinogen | Non-Toxic | Mutagen | Irritant | Irritant | Irritant | Degradable |