A1EIY
Summary
| Name: | (1R)-1-(3,4-dichlorophenyl)-2,2,2-tris(fluoranyl)ethanol |
| Synonyms: | (R)-1-(3,4-dichlorophenyl)-2,2,2-trifluoroethanol |
| Formula: | C8 H5 Cl2 F3 O |
| Formal charge: | 0 |
| Formula weight: | 245.026 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | (1~{R})-1-(3,4-dichlorophenyl)-2,2,2-tris(fluoranyl)ethanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.06 | InChI=1S/C8H5Cl2F3O/c9-5-2-1-4(3-6(5)10)7(14)8(11,12)13/h1-3,7,14H/t7-/m1/s1 |
| InChIKey | InChI | 1.06 | GOCHXDOXYWWSKG-SSDOTTSWSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O[C@H](c1ccc(Cl)c(Cl)c1)C(F)(F)F |
| SMILES | CACTVS | 3.385 | O[CH](c1ccc(Cl)c(Cl)c1)C(F)(F)F |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1[C@H](C(F)(F)F)O)Cl)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(cc1C(C(F)(F)F)O)Cl)Cl |
