Benzimidazole, 5-(methylsulfonyl)-2-(trifluoromethyl)-
Basic information
- CAS
19016-29-6- Standard SMILES
CS(=O)(=O)c1ccc2nc(C(F)(F)F)[nH]c2c1- InChIKey
PUYGYIFHWWRBRD-UHFFFAOYSA-N- Molecular formula
- C9H7F3N2O2S
- Average molar mass
- 264.23 g/mol
- Monoisotopic mass
- 264.01803313
Names & identifiers
- Preferred name
- Benzimidazole, 5-(methylsulfonyl)-2-(trifluoromethyl)-
- IUPAC
- 6-methylsulfonyl-2-(trifluoromethyl)-1H-benzimidazole
Names & synonyms
BRN 0891065Benzimidazole, 5-(methylsulfonyl)-2-(trifluoromethyl)-19016-29-65-(Methylsulfonyl)-2-(trifluoromethyl)benzimidazoleDTXSID00172493RefChem:325930DTXCID6094984AKOS0113470476-(Methanesulfonyl)-2-(trifluoromethyl)-1H-1,3-benzimidazole
Database identifiers
- CAS
19016-29-6- PubChem CID
- 197975
- DTXSID
DTXSID00172493
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 71.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 390
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…