K17
Summary
| Name: | 4,5,6,7-TETRABROMO-BENZIMIDAZOLE |
| Formula: | C7 H2 Br4 N2 |
| Formal charge: | 0 |
| Formula weight: | 433.72 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 4,5,6,7-tetrabromo-1H-benzimidazole |
| OpenEye OEToolkits | 1.5.0 | 4,5,6,7-tetrabromo-1H-benzimidazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | Brc2c1c(ncn1)c(Br)c(Br)c2Br |
| SMILES_CANONICAL | CACTVS | 3.341 | Brc1c(Br)c(Br)c2nc[nH]c2c1Br |
| SMILES | CACTVS | 3.341 | Brc1c(Br)c(Br)c2nc[nH]c2c1Br |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1[nH]c2c(n1)c(c(c(c2Br)Br)Br)Br |
| SMILES | OpenEye OEToolkits | 1.5.0 | c1[nH]c2c(n1)c(c(c(c2Br)Br)Br)Br |
| InChI | InChI | 1.03 | InChI=1S/C7H2Br4N2/c8-2-3(9)5(11)7-6(4(2)10)12-1-13-7/h1H,(H,12,13) |
| InChIKey | InChI | 1.03 | LOEIRDBRYBHAJB-UHFFFAOYSA-N |
