Showing Metabocard for 3-acetylamino-4-hydroxybenzoate (BASm0009587)
| Common Name | 3-acetylamino-4-hydroxybenzoate |
|---|---|
| Description | A carboxylic acid anion resulting from the deprotonation of the carboxy group of 3-acetamido-4-hydroxybenzoic acid. The major microspecies at pH 7.3. |
| Structure | |
| Molecular Formula | C9H8NO4 |
| Average Mass | 194.16400 |
| Monoisotopic Mass | Not Available |
| IUPAC Name | Not Available |
| Traditional Name | Not Available |
| CAS Registry Number | Not Available |
| SMILES | CC(=O)Nc1cc(C(=O)[O-])ccc1O |
| InChI Identifier | InChI=1S/C9H9NO4/c1-5(11)10-7-4-6(9(13)14)2-3-8(7)12/h2-4,12H,1H3,(H,10,11)(H,13,14)/p-1 |
| InChI Key | BXBFVCYLJXGOGI-UHFFFAOYSA-M |
| CHEBI ID | CHEBI:140533 |
| State | Not Available |
| Water Solubility | Not Available |
| logS | Not Available |
| pKa (Strongest Acidic) | Not Available |
| pKa (Strongest Basic) | Not Available |
| Hydrogen Acceptor Count | Not Available |
| Hydrogen Donor Count | Not Available |
| Rotatable Bond Count | Not Available |
| Physiological Charge | Not Available |
| Formal Charge | -1 |
| Polarizability | Not Available |