4LE
Summary
| Name: | (2R)-2-chloro-2-(difluoromethoxy)-1,1,1-trifluoroethane |
| Formula: | C3 H2 Cl F5 O |
| Formal charge: | 0 |
| Formula weight: | 184.492 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (2R)-2-chloro-2-(difluoromethoxy)-1,1,1-trifluoroethane |
| OpenEye OEToolkits | 1.9.2 | (2R)-2-[bis(fluoranyl)methoxy]-2-chloranyl-1,1,1-tris(fluoranyl)ethane |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | (1R)-1-chloro-2,2,2-trifluoroethyl difluoromethyl ether |
| InChI | InChI | 1.03 | InChI=1S/C3H2ClF5O/c4-1(3(7,8)9)10-2(5)6/h1-2H/t1-/m0/s1 |
| InChIKey | InChI | 1.03 | PIWKPBJCKXDKJR-SFOWXEAESA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | FC(F)O[C@H](Cl)C(F)(F)F |
| SMILES | CACTVS | 3.385 | FC(F)O[CH](Cl)C(F)(F)F |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.9.2 | [C@@H](C(F)(F)F)(OC(F)F)Cl |
| SMILES | OpenEye OEToolkits | 1.9.2 | C(C(F)(F)F)(OC(F)F)Cl |
