1H-Benzimidazole, 6-chloro-1-ethyl-2-methyl-5-(trifluoromethyl)-
Basic information
- CAS
1736-34-1- Standard SMILES
CCn1c(C)nc2cc(C(F)(F)F)c(Cl)cc21- InChIKey
ZINJVKDSCBDJRX-UHFFFAOYSA-N- Molecular formula
- C11H10ClF3N2
- Average molar mass
- 262.66 g/mol
- Monoisotopic mass
- 262.0484605
Names & identifiers
- Preferred name
- 1H-Benzimidazole, 6-chloro-1-ethyl-2-methyl-5-(trifluoromethyl)-
- IUPAC
- 6-chloro-1-ethyl-2-methyl-5-(trifluoromethyl)benzimidazole
- English name
- 6-chloro-1-ethyl-2-methyl-5-(trifluoromethyl)-1H-benzimidazole
- Molecular formula
- C11H10ClF3N2
- Molecular weight
- 262.66
Names & synonyms
6-Chloro-1-ethyl-2-methyl-5-(trifluoromethyl)-1H-benzimidazole1H-Benzimidazole, 6-chloro-1-ethyl-2-methyl-5-(trifluoromethyl)-EINECS 217-082-0DTXSID2061933RefChem:79681DTXCID4035544217-082-01736-34-16-Chloro-1-ethyl-2-methyl-5-(trifluoromethyl)-1H-benzo[d]imidazole6-chloro-1-ethyl-2-methyl-5-(trifluoromethyl)benzimidazole6-chloro-1-ethyl-2-methyl-5-(trifluoromethyl)-1H-1,3-benzodiazoleSCHEMBL11810252
Show more names
6-chloro-1-ethyl-2-methyl-5-trifluoromethyl-1H-benzoimidazole
DB-359349NS00046263SR-01000232797SR-01000232797-16-chloro-1-ethyl-2-methyl-5-trifluoromethylbenzimidazole6-Chloro-1-ethyl-2-methyl-5-(trifluoromethyl)-1H-1,3-benzimidazole
Database identifiers
- CAS
1736-34-1- PubChem CID
- 74434
- DTXSID
DTXSID2061933- EC Number
- 217-082-0
- Nikkaji
- J203.139F
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 17.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 284
Physicochemical properties
- Melting point
- 119 · 119-120 °C
- Boiling point
- 348.1 · 348.1±37.0 °C(Predicted)
- Density
- 1.38 · 1.38±0.1 g/cm3(Predicted)
- pka
- 4.42 · 4.42±0.25(Predicted)
- EPA Substance Registry System
- 1 H-Benzimidazole, · 1H-Benzimidazole, 6-chloro-1-ethyl-2-methyl-5-(trifluoromethyl)- (1736-34-1)
- TSCA
- TSCA listed
- HS Code
- 2933990099 · 2933990099
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
- hs_code
- 2933990099
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1H-Benzimidazole, 6-chloro-1-ethyl-2-methyl-5-(trifluoromethyl)-: ACTIVE
Related reactions
3 records
Compound notes
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