Pubchem ID | 978 |
---|---|
CAS | 150-13-0 |
IUPAC name | 4-aminobenzoic acid |
Synonyms | 4-aminobenzoic acid|PABA|para-aminobenzoic acid|Vitamin BX|p-Carboxyaniline|4-Carboxyaniline|Benzoic acid, 4-amino- |
Categories | Nutrition enhancer |
SMILES | C1=CC(=CC=C1C(=O)O)N |
InCheykey | InChI=1S/C7H7NO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4H,8H2,(H,9,10) |
Natural | nan |
E No. | - |
GHS Siginal | Warning |
ADI Value | - |
Molecular weight | Hydrogen Bond Donor count | Hydrogen Bond Acceptor count | Rotatable bonds | Topological Polor Surface Area |
---|---|---|---|---|
137.138 | 2 | 3 | 1 | 63.3 |
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 | Low | Non - Inhibitor | Toxic |
Carcinogenicity | Developmental Toxicity | Mutagenicity (Ames) | Skin Irritancy | Skin Sensitization | Ocular Irritancy | Aerobic Biodegradability |
---|---|---|---|---|---|---|
Carcinogen | Non-Toxic | Non-Mutagen | Non-Irritant | Irritant | Irritant | Non-Degradable |