Benzimidazole, 6-bromo-4-nitro-2-(trifluoromethyl)-
Basic information
- CAS
6609-36-5- Standard SMILES
O=[N+]([O-])c1cc(Br)cc2[nH]c(C(F)(F)F)nc12- InChIKey
USUPLSWSXSTERT-UHFFFAOYSA-N- Molecular formula
- C8H3BrF3N3O2
- Average molar mass
- 310.03 g/mol
- Monoisotopic mass
- 308.93607
Names & identifiers
- Preferred name
- Benzimidazole, 6-bromo-4-nitro-2-(trifluoromethyl)-
- IUPAC
- 6-bromo-4-nitro-2-(trifluoromethyl)-1H-benzimidazole
Names & synonyms
BENZIMIDAZOLE, 6-BROMO-4-NITRO-2-(TRIFLUOROMETHYL)-BRN 09260846609-36-56-Bromo-4-nitro-2-(trifluoromethyl)benzimidazoleDTXSID00216280RefChem:325964DTXCID00138771USUPLSWSXSTERT-UHFFFAOYSA-N6-Bromo-4-nitro-2-(trifluoromethyl)-1H-1,3-benzimidazole
Database identifiers
- CAS
6609-36-5- PubChem CID
- 23090
- DTXSID
DTXSID00216280
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 74.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 0
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 322
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…