U6L
Summary
| Name: | (1~{R})-1-(3-ethylphenyl)ethane-1,2-diol |
| Synonyms: | SCHEMBL24015313 |
| Formula: | C10 H14 O2 |
| Formal charge: | 0 |
| Formula weight: | 166.217 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (1~{R})-1-(3-ethylphenyl)ethane-1,2-diol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C10H14O2/c1-2-8-4-3-5-9(6-8)10(12)7-11/h3-6,10-12H,2,7H2,1H3/t10-/m0/s1 |
| InChIKey | InChI | 1.06 | ZPNNJYNIHQZIJX-JTQLQIEISA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CCc1cccc(c1)[C@@H](O)CO |
| SMILES | CACTVS | 3.385 | CCc1cccc(c1)[CH](O)CO |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CCc1cccc(c1)[C@H](CO)O |
| SMILES | OpenEye OEToolkits | 2.0.7 | CCc1cccc(c1)C(CO)O |
