Benzoyl Formic Acid
Representations & DB's id
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| ChEBI: | CHEBI:18280 | |
|---|---|---|
| ChEMBL: | CHEMBL950 | |
| PubChem: | 11915 | |
| IUPAC: | 2-oxo-2-phenylacetic acid | |
| Standard InChI: | InChI=1S/C8H6O3/c9-7(8(10)11)6-4-2-1-3-5-6/h1-5H,(H,10,11) | |
| Standard InChI Key: | FAQJJMHZNSSFSM-UHFFFAOYSA-N | |
| SMILES: | O=C(c1ccccc1)C(=O)O | |
Molecular propeties
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| AlogP: | 0.95 | |
|---|---|---|
| Hydrogen bonds acceptors: | 2 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 2 | |
| Number of rings: | 1 | |
| Molecular Weight: | 150.03 | |
| Topological polar surface area: | 54.4 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0 | |
| Number of carbons: | 8 | |