2-(Difluoromethyl)-5,7-bis(trifluoromethyl)-1H-benzimidazole
Basic information
- CAS
185412-90-2- Standard SMILES
FC(F)c1nc2c(C(F)(F)F)cc(C(F)(F)F)cc2[nH]1- InChIKey
YMDDEILBFASUDY-UHFFFAOYSA-N- Molecular formula
- C10H4F8N2
- Average molar mass
- 304.14 g/mol
- Monoisotopic mass
- 304.02467343
Names & identifiers
- Preferred name
- 2-(Difluoromethyl)-5,7-bis(trifluoromethyl)-1H-benzimidazole
- IUPAC
- 2-(difluoromethyl)-4,6-bis(trifluoromethyl)-1H-benzimidazole
Names & synonyms
DTXSID4011852512-(Difluoromethyl)-5,7-bis(trifluoromethyl)-1H-benzimidazole185412-90-2
Database identifiers
- CAS
185412-90-2- PubChem CID
- 85708312
- DTXSID
DTXSID401185251
Properties
Computed structural properties
- XLogP
- 3.9
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 1
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 352
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Compound notes
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