(4-Chloro-3-cyanophenyl)boronic acid

Basic Information

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CAS Number

871332-95-5

Molecular Formula

C7H5BClNO2

Molecular Weight

181.38 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

300-304

SMILES

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OB(O)c1ccc(Cl)c(C#N)c1

InChI

InChI=1S/C7H5BClNO2/c9-7-2-1-6(8(11)12)3-5(7)4-10/h1-3,11-12H

InChIKey

PRPLADNLEYNYFZ-UHFFFAOYSA-N

LogP

-0.10852

Complexity

203

Safety Information

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Hazard Statement

Hazard Class

Class 6.1 Class 6.1

Synonyms & References

English

(4-Chloro-3-cyanophenyl)boronic acid
4-Chloro-3-cyanobenzeneboronic acid
4-Chloro-3-cyanophenylboronic acid
4-Chloro-3-cyanophenylboronicacid
(4-chloro-3-cyano-phenyl)boronic acid
PubChem17104
KSC447Q0N
PRPLADNLEYNYFZ-UHFFFAOYSA-N
FCH919650
OR9397
AM804448
(4-chloro-3-cyanophenyl)boronic acid

MDL Number

MFCD08056360

Customs Code

2931900090

FAQ

What is (4-Chloro-3-cyanophenyl)boronic acid (CAS: 871332-95-5)?

(4-Chloro-3-cyanophenyl)boronic acid is an organic compound with the formula [C8H5ClNO2]B(OH)2. It is a boronic acid derivative used in organic synthesis, particularly in Suzuki coupling reactions and other cross-coupling reactions in the field of medicinal chemistry.

What are the main uses of (4-Chloro-3-cyanophenyl)boronic acid (CAS: 871332-95-5)?

(4-Chloro-3-cyanophenyl)boronic acid is primarily used in pharmaceutical and chemical research for cross-coupling reactions, particularly in the synthesis of drug molecules and organic compounds. It is a valuable reagent in the fields of medicinal and materials chemistry.

Is (4-Chloro-3-cyanophenyl)boronic acid (CAS: 871332-95-5) safe?

When handled properly, (4-Chloro-3-cyanophenyl)boronic acid is considered safe. It is important to follow safety guidelines, including the use of gloves, goggles, and a fume hood. Avoid contact with skin and eyes, and ensure proper ventilation. Keep away from fire and heat sources.

How should (4-Chloro-3-cyanophenyl)boronic acid (CAS: 871332-95-5) be stored?

(4-Chloro-3-cyanophenyl)boronic acid should be stored in a cool, dry place, away from direct sunlight and heat sources. Store in a tightly sealed container to prevent moisture absorption. Maintain a temperature below 25°C and avoid exposure to high humidity to preserve its stability and effectiveness.