Uses Chemical Properties
ChemicalBook > CAS DataBase List > 4-Cyanobenzyl bromide

4-Cyanobenzyl bromide

Uses Chemical Properties
Product Name
4-Cyanobenzyl bromide
CAS No.
17201-43-3
Chemical Name
4-Cyanobenzyl bromide
Synonyms
4-(BROMOMETHYL)BENZONITRILE;Para Cyano Benzyl Bromide;A-BROMO-P-TOLUNITRILE;4CNBB;NSC 95792;AKOS BC-3028;4-Cyanobenzyl;AKOS BBS-00003970;4-Cyanobezyl Bromide;4-Cynobenzyl bromide
CBNumber
CB7279647
Molecular Formula
C8H6BrN
Formula Weight
196.04
MOL File
17201-43-3.mol
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4-Cyanobenzyl bromide Property

Melting point:
115-117 °C(lit.)
Boiling point:
143 °C / 12mmHg
Density 
1.5466 (rough estimate)
refractive index 
1.6550 (estimate)
storage temp. 
Inert atmosphere,2-8°C
solubility 
Chloroform (Slightly), Methanol (Slightly)
form 
Liquid
color 
Clear colorless to yellow
Water Solubility 
Soluble in chloroform and methanol. Insoluble in water.
BRN 
636717
InChI
InChI=1S/C8H6BrN/c9-5-7-1-3-8(6-10)4-2-7/h1-4H,5H2
InChIKey
UMLFTCYAQPPZER-UHFFFAOYSA-N
SMILES
C(#N)C1=CC=C(CBr)C=C1
CAS DataBase Reference
17201-43-3(CAS DataBase Reference)
NIST Chemistry Reference
«ALPHA»-bromo-p-tolunitrile(17201-43-3)
EPA Substance Registry System
Benzonitrile, 4-(bromomethyl)- (17201-43-3)
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Safety

Hazard Codes 
C
Risk Statements 
34-42/43
Safety Statements 
22-26-36/37/39-45-28A
RIDADR 
UN 3261 8/PG 2
WGK Germany 
3
10-19-21
Hazard Note 
Corrosive
TSCA 
Yes
HazardClass 
8
PackingGroup 
II
HS Code 
29269090
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Hazard and Precautionary Statements (GHS)

Symbol(GHS)
Signal word
Danger
Hazard statements

H314Causes severe skin burns and eye damage

H334May cause allergy or asthma symptoms or breathing difficulties if inhaled

Precautionary statements

P260Do not breathe dust/fume/gas/mist/vapours/spray.

P280Wear protective gloves/protective clothing/eye protection/face protection.

P284Wear respiratory protection.

P303+P361+P353IF ON SKIN (or hair): Remove/Take off Immediately all contaminated clothing. Rinse SKIN with water/shower.

P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
144061
Product name
4-(Bromomethyl)benzonitrile
Purity
99%
Packaging
1g
Price
$37.5
Updated
2025/07/31
Sigma-Aldrich
Product number
144061
Product name
4-(Bromomethyl)benzonitrile
Purity
99%
Packaging
10g
Price
$120
Updated
2025/07/31
TCI Chemical
Product number
C1398
Product name
4-Cyanobenzyl Bromide
Purity
>98.0%(GC)(T)
Packaging
25g
Price
$103
Updated
2025/07/31
TCI Chemical
Product number
C1398
Product name
4-Cyanobenzyl Bromide
Purity
>98.0%(GC)(T)
Packaging
250g
Price
$465
Updated
2025/07/31
Sigma-Aldrich
Product number
144061
Product name
4-(Bromomethyl)benzonitrile
Purity
99%
Packaging
50g
Price
$350
Updated
2025/07/31
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4-Cyanobenzyl bromide Chemical Properties,Usage,Production

Uses

4-Cyanobenzyl bromide is an important intermediate for pharmaceutical production. It can be used for the synthesis of a series of piperidine-linked aromatic diimidazolines, which have been synthesized as conformationally restricted congeners of the anti-Pneumocystis carinii (PCP) drug, Pentamidine.

Chemical Properties

4-Cyanobenzyl bromide (C8H6BrN, CAS registry No. 17201-43-3) is a white solid. Its melting point is 113-117°C, and flash point is 125.1°C. It is insoluble in water at 20°C. It is stable under normal temperatures and pressures. It should be stored at 0-5°C.

Chemical Properties

white to light yellow crystal powde

Uses

A benzyl halide as postemergence herbicides.

Uses

4-(Bromomethyl)benzonitrile is used in the synthesis of ligands containing a chelating pyrazolyl-pyridine group with a pendant aromatic nitrile. It is also useful in the preparation of 4-[(2H-tetra-zol-2-yl)methyl]benzonitrile by reaction with 2H-tetrazole in the presence of potassium hydroxide.

Uses

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

General Description

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

Synthesis

874-89-5

17201-43-3

GENERAL METHOD: Hydroxymethyl (1 mmol) and potassium bromide (1.5 mmol, 0.18 g) were dissolved in ethanol (5 mL) and phosphorus pentoxide (1.5 mmol, 0.23 g) was added. The reaction mixture was stirred at room temperature until the reaction was complete (monitored by TLC or GC). After completion of the reaction, the mixture was filtered and the residue was washed with ethyl acetate (3 x 8 mL). The organic layers were combined, washed with water (10 mL) and dried over anhydrous sodium sulfate. The solvent was removed by concentration under reduced pressure to give the crude 4-cyanobenzyl bromide product. If further purification is required, column chromatography can be used.

References

[1] Tetrahedron Letters, 2016, vol. 57, # 2, p. 168 - 171
[2] Organic Letters, 2015, vol. 17, # 15, p. 3810 - 3813
[3] Advanced Synthesis and Catalysis, 2016, vol. 358, # 11, p. 1731 - 1735
[4] Patent: US6384080, 2002, B1

4-Cyanobenzyl bromide Preparation Products And Raw materials

Raw materials

Preparation Products

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View Lastest Price from 4-Cyanobenzyl bromide manufacturers

WUHAN FORTUNA CHEMICAL CO., LTD
Product
4-Cyanobenzyl bromide 17201-43-3
Price
US $0.00/KG
Min. Order
1KG
Purity
98%min
Supply Ability
30tons/month
Release date
2023-04-07
Hebei Zhanyao Biotechnology Co. Ltd
Product
4-Cyanobenzyl bromide 17201-43-3
Price
US $10.00/KG
Min. Order
1KG
Purity
99%
Supply Ability
20 tons
Release date
2021-10-19
Career Henan Chemical Co
Product
4-Cyanobenzyl bromide 17201-43-3
Price
US $1.00/KG
Min. Order
1KG
Purity
99%
Supply Ability
1000KG
Release date
2018-08-09

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