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Key Documents

264458

Sigma-Aldrich

3,4-Difluorobenzyl bromide

98%

Synonym(s):

α-Bromo-3,4-difluorotoluene

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About This Item

Linear Formula:
F2C6H3CH2Br
CAS Number:
Molecular Weight:
207.02
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22

Assay

98%

form

liquid

refractive index

n20/D 1.526 (lit.)

density

1.618 g/mL at 25 °C (lit.)

functional group

bromo
fluoro

SMILES string

Fc1ccc(CBr)cc1F

InChI

1S/C7H5BrF2/c8-4-5-1-2-6(9)7(10)3-5/h1-3H,4H2

InChI key

JJIFTOPVKWDHJI-UHFFFAOYSA-N

Application

3,4-Difluorobenzyl bromide has been used in the synthesis of series of benzothiophene-based phosphonates.

Pictograms

CorrosionExclamation mark

Signal Word

Danger

Hazard Statements

Hazard Classifications

Eye Dam. 1 - Skin Corr. 1B - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

8A - Combustible corrosive hazardous materials

WGK

WGK 3

Flash Point(F)

174.2 °F - closed cup

Flash Point(C)

79 °C - closed cup

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

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Jay M Matthews et al.
Bioorganic & medicinal chemistry letters, 22(8), 2922-2926 (2012-03-17)
A series of benzothiophene-based phosphonates was synthesized and many analogs within the series were shown to be potent antagonists of the TRPM8 channel. The compounds were obtained as a racemic mixture in 5 synthetic steps, and were tested for TRPM8

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