Pubchem ID | 239 |
---|---|
CAS | 107-95-9 |
IUPAC name | 3-aminopropanoic acid |
Synonyms | Carboxyethylamine|.beta.-Alanine|Propanoic acid, 3-amino-|Alanine, beta-|3-Aminopropionsaeure|beta-Ala|beta-Aminopropionsaeure|omega-Aminopropionic acid|3-Aminopropanoate |
Categories | Flavor enhancer |
SMILES | C(CN)C(=O)O |
InCheykey | InChI=1S/C3H7NO2/c4-2-1-3(5)6/h1-2,4H2,(H,5,6) |
Natural | YES |
E No. | - |
GHS Siginal | - |
ADI Value | - |
Molecular weight | Hydrogen Bond Donor count | Hydrogen Bond Acceptor count | Rotatable bonds | Topological Polor Surface Area |
---|---|---|---|---|
89.094 | 2 | 3 | 2 | 63.3 |
Human Intestinal Absorption | Aqueous Solubility Level | Plasma Protein Binding Level | Blood Brain Barrier Penetration | CYP2DE Binding Level | Hepatotoxicity Level |
---|---|---|---|---|---|
Good Absorption | Too Soluble | Weaker / Non binder | Low | Non - Inhibitor | Non Toxic |
Carcinogenicity | Developmental Toxicity | Mutagenicity (Ames) | Skin Irritancy | Skin Sensitization | Ocular Irritancy | Aerobic Biodegradability |
---|---|---|---|---|---|---|
Non-Carcinogen | Toxic | Non-Mutagen | Irritant | Non-Irritant | Irritant | Degradable |