WPK
Summary
| Name: | 6-chloro-5-fluoro-1H-benzimidazole |
| Formula: | C7 H4 Cl F N2 |
| Formal charge: | 0 |
| Formula weight: | 170.571 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 6-chloro-5-fluoro-1H-benzimidazole |
| OpenEye OEToolkits | 2.0.7 | 6-chloranyl-5-fluoranyl-1~{H}-benzimidazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | Fc1cc2nc[NH]c2cc1Cl |
| InChI | InChI | 1.06 | InChI=1S/C7H4ClFN2/c8-4-1-6-7(2-5(4)9)11-3-10-6/h1-3H,(H,10,11) |
| InChIKey | InChI | 1.06 | YITVVUARATZCAT-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Fc1cc2nc[nH]c2cc1Cl |
| SMILES | CACTVS | 3.385 | Fc1cc2nc[nH]c2cc1Cl |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1c2c(cc(c1Cl)F)nc[nH]2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1c2c(cc(c1Cl)F)nc[nH]2 |
