Basic information
- CAS
89457-10-3- Standard SMILES
FC(F)(F)c1nc2c(Cl)cc(Br)cc2[nH]1- InChIKey
GQUMVBCXDLOULU-UHFFFAOYSA-N- Molecular formula
- C8H3BrClF3N2
- Average molar mass
- 299.47 g/mol
- Monoisotopic mass
- 297.91202
Names & identifiers
- Preferred name
- 5-Bromo-7-chloro-2-(trifluoromethyl)-1H-benzimidazole
- IUPAC
- 6-bromo-4-chloro-2-(trifluoromethyl)-1H-benzimidazole
Names & synonyms
89457-10-3BENZIMIDAZOLE, 6-BROMO-4-CHLORO-2-(TRIFLUOROMETHYL)-DTXSID70237725RefChem:1072739DTXCID201602165-Bromo-7-chloro-2-(trifluoromethyl)-1H-benzimidazole6-bromo-4-chloro-2-(trifluoromethyl)-1H-benzimidazole1H-Benzimidazole, 5-bromo-7-chloro-2-(trifluoromethyl)-6-Bromo-4-chloro-2-(trifluoromethyl)benzimidazoleGQUMVBCXDLOULU-UHFFFAOYSA-N6-Bromo-4-chloro-2-(trifluoromethyl)-1H-1,3-benzimidazole
Database identifiers
- CAS
89457-10-3- PubChem CID
- 55972
- DTXSID
DTXSID70237725
Properties
Computed structural properties
- XLogP
- 3.6
- 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
- 251
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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