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114772-54-2

114772-54-2 structural image
Product Name: 4-Bromomethyl-2-cyanobiphenyl
Formula: C14H10BrN
Synonyms: 2-Cyano-4′-bromomethylbiphenyl;4′-(Bromomethyl)-2-cyanobiphenyl
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Exclamation Mark
Irritant
GHS07

Environment
GHS09
GHS Hazard Statements H317:Sensitisation, Skin
H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P261:Avoid breathing dust/fume/gas/mist/vapours/spray.
P272:Contaminated work clothing should not be allowed out of the workplace.
P273:Avoid release to the environment.
P280:Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:IF ON SKIN: wash with plenty of soap and water.
P333+P313:IF SKIN irritation or rash occurs: Get medical advice/attention.

COMPUTED DESCRIPTORS

Molecular Weight 272.14 g/mol
XLogP3 3.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 1
Rotatable Bond Count 2
Exact Mass 270.99966 g/mol
Monoisotopic Mass 270.99966 g/mol
Topological Polar Surface Area 23.8 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 259
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

Description

4-Bromomethyl-2-cyanobiphenyl is Cream powder. It is an important pharmaceutical intermediate and organic synthetic material used to prepare drugs of the sartan class, such as azilsartan ester and temisartan. It is also used in the synthesis of other pyrazolines and related derivatives. In addition, recently reported studies on the role of 4-Bromomethyl-2-cyanobiphenyl in determining potential genotoxic impurities in temesartan using ESI-MS/MS technique and thermodynamic studies in different solvents.

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