Pubchem ID | 8158 |
---|---|
CAS | 112-05-0 |
IUPAC name | nonanoic acid |
Synonyms | Pelargonic acid|n-Nonanoic acid|Nonylic acid|Pelargic acid|Nonoic acid|n-Nonylic acid|n-Nonoic acid|1-Octanecarboxylic acid|Pelargon|Cirrasol 185A|Hexacid C-9|Emfac 1202|Nonanoate |
Categories | Flavor enhancer |
SMILES | CCCCCCCCC(=O)O |
InCheykey | InChI=1S/C9H18O2/c1-2-3-4-5-6-7-8-9(10)11/h2-8H2,1H3,(H,10,11) |
Natural | YES |
E No. | - |
GHS Siginal | - |
ADI Value | - |
Molecular weight | Hydrogen Bond Donor count | Hydrogen Bond Acceptor count | Rotatable bonds | Topological Polor Surface Area |
---|---|---|---|---|
158.241 | 1 | 2 | 7 | 37.3 |
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 | Non - Inhibitor | Non Toxic |
Carcinogenicity | Developmental Toxicity | Mutagenicity (Ames) | Skin Irritancy | Skin Sensitization | Ocular Irritancy | Aerobic Biodegradability |
---|---|---|---|---|---|---|
Non-Carcinogen | Non-Toxic | Non-Mutagen | Irritant | Non-Irritant | Non-Irritant | Degradable |