2-Bromo-1-[2-(trifluoromethyl)phenyl]propan-1-one
Basic information
- CAS
104384-69-2- Standard SMILES
CC(Br)C(=O)c1ccccc1C(F)(F)F- InChIKey
HEFXTBTYIGBJDA-UHFFFAOYSA-N- Molecular formula
- C10H8BrF3O
- Average molar mass
- 281.07 g/mol
- Monoisotopic mass
- 279.97106
Names & identifiers
- Preferred name
- 2-Bromo-1-[2-(trifluoromethyl)phenyl]propan-1-one
- IUPAC
- 2-bromo-1-[2-(trifluoromethyl)phenyl]propan-1-one
- English name
- 2-Bromo-1-(2-trifluoromethylphenyl)-propan-1-one
- Molecular formula
- C10H8BrF3O
- Molecular weight
- 281.07
Names & synonyms
104384-69-22-bromo-1-[2-(trifluoromethyl)phenyl]propan-1-one2-bromo-1-(2-(trifluoromethyl)phenyl)propan-1-one2-Bromo-2'-(trifluoromethyl)propiophenoneMFCD183923942-Bromo-1-[2-(trifluoromethyl)phenyl]-1-propanone2-bromo-1-(2-trifluoromethyl-phenyl)-propan-1-one2-Bromo-2?-(trifluoromethyl)propiophenoneEsaxerenone Impurity 24SCHEMBL2027517SCHEMBL29410859AKOS030239337
Show more names
RMA02425ESAX-0022-Bromo-2-(trifluoromethyl)propiophenone1-?????? Bromo-1-(2trifluoromethylphenyl)-propan-1-one
PS-9805SY158740CS-0434538EN300-174190G327762-Bromo-1-(2-trifluoromethylphenyl)-propan-1-oneF5113251-Propanone, 2-bromo-1-[2-(trifluoromethyl)phenyl]-
Database identifiers
- CAS
104384-69-2- PubChem CID
- 20187474
- Nikkaji
- J1.882.245H
Properties
Computed structural properties
- XLogP
- 3.7
- Topological polar surface area
- 17.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 239
Physicochemical properties
- Boiling point
- 268.484 · 268.484±40.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.523 · 1.523±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- Symbol(GHS)
- 5 · GHS05,GHS07
- Signal word
- Danger
- Hazard statements
- 315 · H315-H318-H335
- Precautionary statements
- 280 · P280-P271-P261
- HS Code
- 2914390090 · 2914390090
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
- 2914390090
- Signal word
- Danger
- Symbol(GHS)
- GHS05,GHS07
- Hazard statements
- H315-H318-H335
- Precautionary statements
- P280-P271-P261
Suppliers
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Related reactions
6 records
Compound notes
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