QPK
Summary
| Name: | 3-chloranyl-2,6-bis(fluoranyl)phenol |
| Formula: | C6 H3 Cl F2 O |
| Formal charge: | 0 |
| Formula weight: | 164.537 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 2.0.7 | 3-chloranyl-2,6-bis(fluoranyl)phenol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/C6H3ClF2O/c7-3-1-2-4(8)6(10)5(3)9/h1-2,10H |
| InChIKey | InChI | 1.03 | CCLYWHXHYLQWQK-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Oc1c(F)ccc(Cl)c1F |
| SMILES | CACTVS | 3.385 | Oc1c(F)ccc(Cl)c1F |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc(c(c(c1F)O)F)Cl |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc(c(c(c1F)O)F)Cl |
