Basic information
- CAS
89457-11-4- Standard SMILES
Fc1cc2[nH]c(C(F)(F)F)nc2c(Br)c1Cl- InChIKey
LQPBTVYGNVQAED-UHFFFAOYSA-N- Molecular formula
- C8H2BrClF4N2
- Average molar mass
- 317.46 g/mol
- Monoisotopic mass
- 315.9026
Names & identifiers
- Preferred name
- 7-Bromo-6-chloro-5-fluoro-2-(trifluoromethyl)-1H-benzimidazole
- IUPAC
- 4-bromo-5-chloro-6-fluoro-2-(trifluoromethyl)-1H-benzimidazole
Names & synonyms
89457-11-4BENZIMIDAZOLE, 4-BROMO-5-CHLORO-6-FLUORO-2-(TRIFLUOROMETHYL)-DTXSID30237726RefChem:1074363DTXCID801602177-Bromo-6-chloro-5-fluoro-2-(trifluoromethyl)-1H-benzimidazole4-Bromo-5-chloro-6-fluoro-2-(trifluoromethyl)benzimidazole4-Bromo-5-chloro-6-fluoro-2-(trifluoromethyl)-1H-1,3-benzimidazole
Database identifiers
- CAS
89457-11-4- PubChem CID
- 55973
- DTXSID
DTXSID30237726
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 277
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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