Methyl Salicylate
Representations & DB's id
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| ChEBI: | CHEBI:31832 | |
|---|---|---|
| ChEMBL: | CHEMBL108545 | |
| PubChem: | 4133 | |
| IUPAC: | methyl 2-hydroxybenzoate | |
| Standard InChI: | InChI=1S/C8H8O3/c1-11-8(10)6-4-2-3-5-7(6)9/h2-5,9H,1H3 | |
| Standard InChI Key: | OSWPMRLSEDHDFF-UHFFFAOYSA-N | |
| SMILES: | COC(=O)c1ccccc1O | |
Molecular propeties
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| AlogP: | 1.18 | |
|---|---|---|
| Hydrogen bonds acceptors: | 3 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 1 | |
| Number of rings: | 1 | |
| Molecular Weight: | 152.05 | |
| Topological polar surface area: | 46.5 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0.125 | |
| Number of carbons: | 8 | |