6B1
Summary
| Name: | (5,6-dichloro-1H-benzimidazol-2-yl)methanol |
| Formula: | C8 H6 Cl2 N2 O |
| Formal charge: | 0 |
| Formula weight: | 217.052 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | (5,6-dichloro-1H-benzimidazol-2-yl)methanol |
| OpenEye OEToolkits | 2.0.4 | [5,6-bis(chloranyl)-1~{H}-benzimidazol-2-yl]methanol |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c2(cc1nc(nc1cc2Cl)CO)Cl |
| InChI | InChI | 1.03 | InChI=1S/C8H6Cl2N2O/c9-4-1-6-7(2-5(4)10)12-8(3-13)11-6/h1-2,13H,3H2,(H,11,12) |
| InChIKey | InChI | 1.03 | GOUGSJWBRLTBDO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | OCc1[nH]c2cc(Cl)c(Cl)cc2n1 |
| SMILES | CACTVS | 3.385 | OCc1[nH]c2cc(Cl)c(Cl)cc2n1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | c1c2c(cc(c1Cl)Cl)nc([nH]2)CO |
| SMILES | OpenEye OEToolkits | 2.0.4 | c1c2c(cc(c1Cl)Cl)nc([nH]2)CO |
