Basic information
- CAS
6609-53-6- Standard SMILES
FC(F)(F)c1nc2c(Br)cc(Br)cc2[nH]1- InChIKey
IPVBKOUKUCKNIK-UHFFFAOYSA-N- Molecular formula
- C8H3Br2F3N2
- Average molar mass
- 343.93 g/mol
- Monoisotopic mass
- 341.86151
Names & identifiers
- Preferred name
- Benzimidazole, 4,6-dibromo-2-(trifluoromethyl)-
- IUPAC
- 4,6-dibromo-2-(trifluoromethyl)-1H-benzimidazole
Names & synonyms
BENZIMIDAZOLE, 4,6-DIBROMO-2-(TRIFLUOROMETHYL)-4,6-Dibromo-2-(trifluoromethyl)benzimidazole6609-53-6DTXSID40216289RefChem:325888DTXCID901387804,6-dibromo-2-(trifluoromethyl)-1H-benzo[d]imidazole4,6-dibromo-2-(trifluoromethyl)-1H-benzimidazoleCHEMBL228258IPVBKOUKUCKNIK-UHFFFAOYSA-N1H-Benzimidazole, 4,6-dibromo-2-(trifluoromethyl)-4,6-Dibromo-2-(trifluoromethyl)-1H-1,3-benzimidazole
Database identifiers
- CAS
6609-53-6- PubChem CID
- 23097
- DTXSID
DTXSID40216289- ChEMBL
CHEMBL228258- Nikkaji
- J582.063D
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 249
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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