Basic information
- CAS
942034-99-3- Standard SMILES
Cn1c(CCl)nc2cc(C(F)(F)F)ccc21- InChIKey
XWOBZZFDBNGPCI-UHFFFAOYSA-N- Molecular formula
- C10H8ClF3N2
- Average molar mass
- 248.63 g/mol
- Monoisotopic mass
- 248.0328104
Names & identifiers
- Preferred name
- 2-Chloromethyl-1-methyl-5-trifluoromethyl-1H-benzoimidazole
- IUPAC
- 2-(chloromethyl)-1-methyl-5-(trifluoromethyl)benzimidazole
- English name
- BUTTPARK 154\19-28
- Molecular formula
- C10H8ClF3N2
- Molecular weight
- 248.63
Names & synonyms
942034-99-32-Chloromethyl-1-methyl-5-trifluoromethyl-1H-benzoimidazole2-(chloromethyl)-1-methyl-5-(trifluoromethyl)benzimidazoleMFCD090284342-(Chloromethyl)-1-methyl-5-(trifluoromethyl)-1H-benzimidazole2-(chloromethyl)-1-methyl-5-(trifluoromethyl)-1H-1,3-benzodiazoleSCHEMBL19664446XWOBZZFDBNGPCI-UHFFFAOYSA-NSBB100482AKOS015850546CS-10354F316570
Show more names
BUTTPARK 154\19-281H-Benzimidazole, 2-(chloromethyl)-1-methyl-5-(trifluoromethyl)-
2-(Chloromethyl)-1-methyl-5-(trifluoromethyl)-1H-benzo[d]imidazole
Database identifiers
- CAS
942034-99-3- PubChem CID
- 56832316
- EC Number
- 193-324-8
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 17.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 259
Physicochemical properties
- Boiling point
- 328.1 · 328.1±42.0 °C(Predicted)
- Density
- 1.42 · 1.42±0.1 g/cm3(Predicted)
- pka
- 3.52 · 3.52±0.10(Predicted)
- HazardClass
- IRRITANT
- HS Code
- 2933998090 · 2933998090
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
- hs_code
- 2933998090
- hazard_class
- IRRITANT
Chemistry & industry
Suppliers1 total
Nanjing Moldeep Biochemical Co., Ltd.+86-25-58282389 +86-17351037455 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…