2FY
Summary
| Name: | 1-(2,4-DIHYDROXY-PHENYL)-PROPAN-1-ONE |
| Formula: | C9 H10 O3 |
| Formal charge: | 0 |
| Formula weight: | 166.174 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-(2,4-dihydroxyphenyl)propan-1-one |
| OpenEye OEToolkits | 1.7.0 | 1-(2,4-dihydroxyphenyl)propan-1-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(c1ccc(O)cc1O)CC |
| SMILES_CANONICAL | CACTVS | 3.370 | CCC(=O)c1ccc(O)cc1O |
| SMILES | CACTVS | 3.370 | CCC(=O)c1ccc(O)cc1O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | CCC(=O)c1ccc(cc1O)O |
| SMILES | OpenEye OEToolkits | 1.7.0 | CCC(=O)c1ccc(cc1O)O |
| InChI | InChI | 1.03 | InChI=1S/C9H10O3/c1-2-8(11)7-4-3-6(10)5-9(7)12/h3-5,10,12H,2H2,1H3 |
| InChIKey | InChI | 1.03 | LLBBBYLDTDJMNU-UHFFFAOYSA-N |
