53C
Summary
| Name: | 1-(3-hydroxyphenyl)ethanone |
| Formula: | C8 H8 O2 |
| Formal charge: | 0 |
| Formula weight: | 136.148 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-(3-hydroxyphenyl)ethanone |
| OpenEye OEToolkits | 1.9.2 | 1-(3-hydroxyphenyl)ethanone |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | CC(=O)c1cc(ccc1)O |
| InChI | InChI | 1.03 | InChI=1S/C8H8O2/c1-6(9)7-3-2-4-8(10)5-7/h2-5,10H,1H3 |
| InChIKey | InChI | 1.03 | LUJMEECXHPYQOF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(=O)c1cccc(O)c1 |
| SMILES | CACTVS | 3.385 | CC(=O)c1cccc(O)c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | CC(=O)c1cccc(c1)O |
| SMILES | OpenEye OEToolkits | 1.9.2 | CC(=O)c1cccc(c1)O |
