Syringic Acid
Representations & DB's id
| ||
| ChEBI: | CHEBI:68329 | |
|---|---|---|
| ChEMBL: | CHEMBL1414 | |
| PubChem: | 10742 | |
| IUPAC: | 4-hydroxy-3,5-dimethoxybenzoic acid | |
| Standard InChI: | InChI=1S/C9H10O5/c1-13-6-3-5(9(11)12)4-7(14-2)8(6)10/h3-4,10H,1-2H3,(H,11,12) | |
| Standard InChI Key: | JMSVCTWVEWCHDZ-UHFFFAOYSA-N | |
| SMILES: | COc1cc(cc(c1O)OC)C(=O)O | |
Molecular propeties
| ||
| AlogP: | 1.11 | |
|---|---|---|
| Hydrogen bonds acceptors: | 4 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 3 | |
| Number of rings: | 1 | |
| Molecular Weight: | 198.05 | |
| Topological polar surface area: | 76 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0.222 | |
| Number of carbons: | 9 | |