| Pubchem ID | 8914 |
|---|---|
| CAS | 143-08-8 |
| IUPAC name | nonan-1-ol |
| Synonyms | 1-Nonanol|Nonan-1-ol|Nonanol|n-Nonyl alcohol|Pelargonic alcohol|Octyl carbinol|1-Hydroxynonane|Nonalol|n-Nonanol|n-Nonan-1-ol |
| Categories | Flavor enhancer |
| SMILES | CCCCCCCCCO |
| InCheykey | InChI=1S/C9H20O/c1-2-3-4-5-6-7-8-9-10/h10H,2-9H2,1H3 |
| Natural | YES |
| E No. | - |
| GHS Siginal | - |
| ADI Value | - |
Physicochemical Properties
| Molecular weight | Hydrogen Bond Donor count | Hydrogen Bond Acceptor count | Rotatable bonds | Topological Polor Surface Area |
|---|---|---|---|---|
| 144.258 | 1 | 1 | 7 | 20.2 |
ADME Predicted Parameters
| 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 | Inhibitor | Non Toxic |
Toxicity Predicted Parameters
| Carcinogenicity | Developmental Toxicity | Mutagenicity (Ames) | Skin Irritancy | Skin Sensitization | Ocular Irritancy | Aerobic Biodegradability |
|---|---|---|---|---|---|---|
| Non-Carcinogen | Non-Toxic | Non-Mutagen | Irritant | Irritant | Irritant | Degradable |