7F6
Summary
| Name: | (1R,2R)-1,2-diphenylethane-1,2-diol |
| Synonyms: | cis-stilbene epoxide, bound form |
| Formula: | C14 H14 O2 |
| Formal charge: | 0 |
| Formula weight: | 214.26 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (1R,2R)-1,2-diphenylethane-1,2-diol |
| OpenEye OEToolkits | 2.0.6 | (1~{R},2~{R})-1,2-diphenylethane-1,2-diol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C(C(c1ccccc1)O)(O)c2ccccc2 |
| InChI | InChI | 1.03 | InChI=1S/C14H14O2/c15-13(11-7-3-1-4-8-11)14(16)12-9-5-2-6-10-12/h1-10,13-16H/t13-,14-/m1/s1 |
| InChIKey | InChI | 1.03 | IHPDTPWNFBQHEB-ZIAGYGMSSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O[C@@H]([C@H](O)c1ccccc1)c2ccccc2 |
| SMILES | CACTVS | 3.385 | O[CH]([CH](O)c1ccccc1)c2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)[C@H]([C@@H](c2ccccc2)O)O |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1ccc(cc1)C(C(c2ccccc2)O)O |
