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145610

Sigma-Aldrich

3-(Bromomethyl)benzonitrile

95%

Synonym(s):

α-Bromo-m-tolunitrile, 3-Cyanobenzyl bromide

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About This Item

Linear Formula:
BrCH2C6H4CN
CAS Number:
28188-41-2
Molecular Weight:
196.04
Beilstein:
742356
EC Number:
248-890-1
MDL number:
MFCD00001809
UNSPSC Code:
12352100
PubChem Substance ID:
24848737
NACRES:
NA.22

Quality Level

100

Assay

95%

mp

93-96 °C

SMILES string

BrCc1cccc(c1)C#N

InChI

1S/C8H6BrN/c9-5-7-2-1-3-8(4-7)6-10/h1-4H,5H2

InChI key

CVKOOKPNCVYHNY-UHFFFAOYSA-N

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General description

3-(Bromomethyl)benzonitrile undergoes Suzuki cross-coupling reaction with bis(pinacolato)diboron.

Application

3-(Bromomethyl)benzonitrile was used in the synthesis of 3-(bromomethyl)benzaldehyde.

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)

Not applicable

Flash Point(C)

Not applicable

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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Lydia C Gilday et al.
Dalton transactions (Cambridge, England : 2003), 41(23), 7092-7097 (2012-05-09)
Triazole and triazolium groups have been integrated into a zinc(II) metalloporphyrin-based structural framework to produce two porphyrin-cages for anion sensing applications. UV/visible spectroscopic titration investigations reveal both host systems exhibit strong anion binding affinities, with the positively-charged triazolium-porphyrin cage capable
Synthesis of benzylic boronates via palladium-catalyzed cross-coupling reaction of bis (pinacolato) diboron with benzylic halides.
Giroux A.
Tetrahedron Letters, 44(2), 233-235 (2003)

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