2-Hydroxy-2-Phenylacetonitrile
Representations & DB's id
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| ChEBI: | CHEBI:16910 | |
|---|---|---|
| ChEMBL: | CHEMBL1393845 | |
| PubChem: | 10758 | |
| IUPAC: | 2-hydroxy-2-phenylacetonitrile | |
| Standard InChI: | InChI=1S/C8H7NO/c9-6-8(10)7-4-2-1-3-5-7/h1-5,8,10H | |
| Standard InChI Key: | NNICRUQPODTGRU-UHFFFAOYSA-N | |
| SMILES: | OC(c1ccccc1)C#N | |
Molecular propeties
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| AlogP: | 1.24 | |
|---|---|---|
| Hydrogen bonds acceptors: | 2 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 1 | |
| Number of rings: | 1 | |
| Molecular Weight: | 133.05 | |
| Topological polar surface area: | 44 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0.125 | |
| Number of carbons: | 8 | |