Key Documents

View All Documentation

144061

4-(Bromomethyl)benzonitrile

Name: 4-(Bromomethyl)benzonitrile
Brand: ALDRICH

99%

Synonym(s):

α-Bromo-p-tolunitrile, 4-Cyanobenzyl bromide

Select a Size

Change View

About This Item

Linear Formula:

BrCH₂C₆H₄CN

CAS Number:

17201-43-3

Molecular Weight:

196.04

UNSPSC Code:

12352100

NACRES:

NA.22

PubChem Substance ID:

24848627

EC Number:

241-246-0

Beilstein/REAXYS Number:

636717

MDL number:

MFCD00001829

Assay:

99%

Form:

solid

Technical Service

Need help? Our team of experienced scientists is here for you.

Let Us Assist

Properties

Quality Level

200

assay

99%

form

solid

mp

115-117 °C (lit.)

functional group

bromo, nitrile

SMILES string

BrCc1ccc(cc1)C#N

InChI

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

InChI key

UMLFTCYAQPPZER-UHFFFAOYSA-N

Description

General description

4-(Bromomethyl)benzonitrile reacts with 2H-tetrazole in the presence of KOH to yield 4-[(2H-tetra-zol-2-yl)methyl]benzonitrile.

Application

4-(Bromomethyl)benzonitrile may be used in the synthesis of ligands containing a chelating pyrazolyl-pyridine group with a pendant aromatic nitrile.

pictograms

GHS08,GHS05

signalword

Danger

hcodes

H314,H334

pcodes

P260 - P280 - P284 - P303 + P361 + P353 - P304 + P340 + P310 - P305 + P351 + P338

Hazard Classifications

Resp. Sens. 1 - Skin Corr. 1B

Storage Class

8A - Combustible corrosive hazardous materials

wgk

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges

Choose from one of the most recent versions:

Certificates of Analysis (COA)

Lot/Batch Number

Don't see the Right Version?

If you require a particular version, you can look up a specific certificate by the Lot or Batch number.

Search for a COA

Already Own This Product?

Find documentation for the products that you have recently purchased in the Document Library.

Visit the Document Library

Hierarchical self-assembly of heteronuclear co-ordination networks.

Hazel Fenton et al.

Dalton transactions (Cambridge, England : 2003), 39(16), 3805-3815 (2010-04-08)

Two ligands L(1) and L(2) have been prepared which contain a chelating pyrazolyl-pyridine group with a pendant aromatic nitrile (in L(1), a benzonitrile; in L(2), a naphthonitrile). These ligands react with Ag(I) salts to give a range of infinite coordination

4-[(2H-Tetra-zol-2-yl)meth-yl]benzonitrile.

Zheng Xing et al.

Acta crystallographica. Section E, Structure reports online, 64(Pt 2), o445-o445 (2008-01-01)

The title compound, C(9)H(7)N(5), was synthesized by reaction of 4-(bromomethyl)benzonitrile and 2H-tetrazole in the presence of KOH. The relative orientation of the planar tetra-zole ring and the methyl-benzonitrile moiety is (-)-anti-clinal. The crystal packing is dominated by van der Waals

Global Trade Item Number

SKU	GTIN
31229-250MG	04061826682111
144061-50G	04061832098104
144061-10G	04061838735324
144061-1G	04061838735331