ChemicalBook--->CAS DataBase List--->157911-56-3

157911-56-3

157911-56-3 Structure

157911-56-3 Structure
IdentificationMore
[Name]

2,4,5-Trifluorobenzyl bromide
[CAS]

157911-56-3
[Synonyms]

1-(BROMOMETHYL)-2,4,5-TRIFLUOROBENZENE
2,4,5-TRIFLUOROBENZYL BROMIDE
alpha-Bromo-2,4,5-trifluorotoluene
à-bromo-2,4,5-trifluorotoluene
2,4,5-Trifluorobenzyl bromide 97%
2,4,5-Trifluorobenzylbromide97%
2,4,5-TRIFLUOROBENZYL BROMIDE,98+%
[EINECS(EC#)]

642-693-8
[Molecular Formula]

C7H4BrF3
[MDL Number]

MFCD00061209
[Molecular Weight]

225.01
[MOL File]

157911-56-3.mol
Chemical PropertiesBack Directory
[Boiling point ]

188.8±35.0 °C(Predicted)
[density ]

1.71
[refractive index ]

1.5015
[storage temp. ]

Inert atmosphere,Room Temperature
[form ]

clear liquid
[color ]

Colorless to Light yellow
[Specific Gravity]

1.71
[Sensitive ]

Lachrymatory
[BRN ]

8312091
[InChI]

InChI=1S/C7H4BrF3/c8-3-4-1-6(10)7(11)2-5(4)9/h1-2H,3H2
[InChIKey]

GAUXEYCSWSMMFZ-UHFFFAOYSA-N
[SMILES]

C1(CBr)=CC(F)=C(F)C=C1F
[CAS DataBase Reference]

157911-56-3(CAS DataBase Reference)
Safety DataBack Directory
[Symbol(GHS) ]

Corrosion (GHS05)
GHS05
[Signal word ]

Danger
[Hazard statements ]

H314-H318
[Precautionary statements ]

P260h-P301+P330+P331-P303+P361+P353-P305+P351+P338-P405-P501a
[Hazard Codes ]

C
[Risk Statements ]

R34:Causes burns.
R36:Irritating to the eyes.
[Safety Statements ]

S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36/37/39:Wear suitable protective clothing, gloves and eye/face protection .
S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
[RIDADR ]

1760
[Hazard Note ]

Corrosive/Lachrymatory
[TSCA ]

T
[HazardClass ]

8
[PackingGroup ]

II
[HS Code ]

29039990
Material Safety Data Sheet(MSDS)Back Directory
[msds information]

2,4,5-Trifluorobenzyl bromide(157911-56-3).msds
Hazard InformationBack Directory
[Chemical Properties]

White low melting solid
[Uses]

2,4,5-trifluorobenzyl bromide is an important intermediate in the synthesis of Ensitrelvir (S-217622). Ensitrelvir is the latest oral drug developed by Japan's Shionogi Pharmaceutical Company to treat COVID-19. It is the first orally active, non-covalent, non-peptide SARS-CoV-23CL protease inhibitor.
[Application]

2,4,5-TRIFLUOROBENZYL BROMIDE is a useful research chemical.
[Synthesis]

Preparing 2,4,5-Trifluorobenzyl bromide, involves (a) carrying out esterification reaction on 2,4,5-trifluorobenzyl chloride and carboxylate to prepare 2,4,5-trifluorobenzyl ester, (b) hydrolyzing 2,4,5-trifluorobenzyl ester to prepare 2,4,5-trifluorobenzyl alcohol, and (c) brominating 2,4,5-trifluorobenzyl alcohol to prepare target product.
Spectrum DetailBack Directory
[Spectrum Detail]

2,4,5-Trifluorobenzyl bromide(157911-56-3)FT-IR
Well-known Reagent Company Product InformationBack Directory
[Alfa Aesar]

2,4,5-Trifluorobenzyl bromide, 98%(157911-56-3)
[TCI AMERICA]

2,4,5-Trifluorobenzyl Bromide,>98.0%(GC)(T)(157911-56-3)
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