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254967

Sigma-Aldrich

2-(Trifluoromethyl)benzyl bromide

96%

Synonym(s):

α′-Bromo-α,α,α-trifluoro-o-xylene

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About This Item

Linear Formula:
CF3C6H4CH2Br
CAS Number:
395-44-8
Molecular Weight:
239.03
EC Number:
206-901-7
MDL number:
MFCD00013558
UNSPSC Code:
12352100
PubChem Substance ID:
24855277
NACRES:
NA.22

Assay

96%

refractive index

n20/D 1.494 (lit.)

bp

72 °C/7.5 mmHg (lit.)

density

1.571 g/mL at 25 °C (lit.)

SMILES string

FC(F)(F)c1ccccc1CBr

InChI

1S/C8H6BrF3/c9-5-6-3-1-2-4-7(6)8(10,11)12/h1-4H,5H2

InChI key

TXVVVEUSVBLDED-UHFFFAOYSA-N

Application

2-(Trifluoromethyl)benzyl bromide may be used in chemical synthesis.

Pictograms

Corrosion
GHS05

Signal Word

Danger

Hazard Statements

H314

Hazard Classifications

Skin Corr. 1B

Storage Class Code

8A - Combustible corrosive hazardous materials

WGK

WGK 3

Flash Point(F)

181.4 °F - closed cup

Flash Point(C)

83 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

Search for Certificates of Analysis (COA) by entering the products Lot/Batch Number. Lot and Batch Numbers can be found on a product’s label following the words ‘Lot’ or ‘Batch’.

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William L Scott et al.
Journal of combinatorial chemistry, 11(1), 14-33 (2008-12-25)
Distributed Drug Discovery (D(3)) proposes solving large drug discovery problems by breaking them into smaller units for processing at multiple sites. A key component of the synthetic and computational stages of D(3) is the global rehearsal of prospective reagents and
William L Scott et al.
Journal of combinatorial chemistry, 11(1), 34-43 (2008-12-25)
For the successful implementation of Distributed Drug Discovery (D(3)) (outlined in the accompanying Perspective), students, in the course of their educational laboratories, must be able to reproducibly make new, high quality, molecules with potential for biological activity. This article reports

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