P18
Summary
| Name: | 3-hydroxy-1-phenylpropan-1-one |
| Formula: | C9 H10 O2 |
| Formal charge: | 0 |
| Formula weight: | 150.174 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 3-hydroxy-1-phenylpropan-1-one |
| OpenEye OEToolkits | 1.9.2 | 3-oxidanyl-1-phenyl-propan-1-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(c1ccccc1)CCO |
| InChI | InChI | 1.03 | InChI=1S/C9H10O2/c10-7-6-9(11)8-4-2-1-3-5-8/h1-5,10H,6-7H2 |
| InChIKey | InChI | 1.03 | PQCFUZMQHVIOSM-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OCCC(=O)c1ccccc1 |
| SMILES | CACTVS | 3.385 | OCCC(=O)c1ccccc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | c1ccc(cc1)C(=O)CCO |
| SMILES | OpenEye OEToolkits | 1.9.2 | c1ccc(cc1)C(=O)CCO |
