5-Bromo-2-methylbenzonitrile

Basic Information

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CAS Number

156001-51-3

Molecular Formula

C8H6BrN

Molecular Weight

185.06 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

48.0 to 52.0 deg-C

Boiling Point

251 ºC

SMILES

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CC1=C(C=C(C=C1)Br)C#N

InChI

InChI=1S/C8H6BrN/c1-6-2-3-8(9)4-7(6)5-10/h2-4H,1H3

InChIKey

WNVUTFDOGUGEIS-UHFFFAOYSA-N

LogP

3.065940000000001

Topological Polar Surface Area

0.0 Å²

Hydrogen Bond Donor/Acceptor

0 / 0

Complexity

158

Safety Information

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GHS Hazard Pictograms

H302

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

W-205795
4-Bromo-2-cyanotoluene
B4808
4-Bromo-o-tolunitrile
p-bromotolunitrile
Benzonitrile,5-bromo-2-methyl-
MFCD08061920
SCHEMBL290322
A21032
156001-51-3
AM20030055
FT-0647697
DTXSID00514551
Benzonitrile, 5-bromo-2-methyl-
EN300-127989
5-Bromo-2-methylbenzonotrile
AC-27966
WNVUTFDOGUGEIS-UHFFFAOYSA-N
3-Bromo-6-methyl-benzonitrile
5-Bromo-2-methylbenzonitrile
5-Bromo-2-methylbenzonitrile, 97%
GS-4291
AKOS013154495
SY004588
CL8223
5-Bromo-2-methyl-benzonitrile
CS-W007610
3-Bromo-6-methylbenzonitrile
Bromo-2-methylbenzonitrile
KSC497G8F
FCH4613626

MDL Number

MFCD08061920

Customs Code

2926909090

FAQ

What is 5-Bromo-2-methylbenzonitrile (CAS: 156001-51-3)?

5-Bromo-2-methylbenzonitrile is an organic compound with the chemical formula C9H7BrCN. It is a colorless to white crystalline solid. This compound is used as an intermediate in the synthesis of various pharmaceuticals and dyes.

What are the main uses of 5-Bromo-2-methylbenzonitrile (CAS: 156001-51-3)?

5-Bromo-2-methylbenzonitrile is primarily used as a precursor in the pharmaceutical and dye industries. It is also utilized in research for the development of new chemical compounds and materials.

Is 5-Bromo-2-methylbenzonitrile (CAS: 156001-51-3) safe?

5-Bromo-2-methylbenzonitrile is generally safe when handled with proper precautions. However, it should be used in a well-ventilated area and protective equipment such as gloves and goggles should be worn. It is important to follow safety guidelines and avoid contact with skin and eyes.

How should 5-Bromo-2-methylbenzonitrile (CAS: 156001-51-3) be stored?

5-Bromo-2-methylbenzonitrile should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed container to prevent moisture absorption. The storage area should be well-ventilated and accessible only to authorized personnel.