(4-Chlorophenyl)boronic acid

Basic Information

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CAS Number

1679-18-1

Molecular Formula

C6H6BClO2

Molecular Weight

156.38 g/mol

Chemical Classification

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

284-289 °C

Boiling Point

295.4°C at 760 mmHg

Density

1.3200

Water Solubility

2.5 g/100 mL

Flash Point

132.4℃

Refractive Index

1.557

SMILES

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B(C1=CC=C(C=C1)Cl)(O)O

InChI

InChI=1S/C6H6BClO2/c8-6-3-1-5(2-4-6)7(9)10/h1-4,9-10H

InChIKey

CAYQIZIAYYNFCS-UHFFFAOYSA-N

LogP

0.01979999999999993

Topological Polar Surface Area

40.46 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

102

Safety Information

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GHS Hazard Pictograms

H302

H312

H332

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H312 Harmful in contact with skin
Acute toxicity, dermal

H332 Harmful if inhaled
Acute toxicity, inhalation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

Boronic acid, (4-chlorophenyl)-
CS-D1133
4-Chlorophenylboronic acid
p-Chlorophenylboronic acid
p-Chlorobenzeneboronic acid
FT-0601204
NSC-25408
(p-Chlorophenyl)metaboric acid
EN300-29827
BDBM92725
AS-2333
A810921
4chlorophenyl boronic acid
F9995-0588
4-chlorphenylboronic acid
Z295122658
4-chloro-phenyl boronic acid
AM20060350
CAYQIZIAYYNFCS-UHFFFAOYSA-N
p-chloro phenylboronic acid
4-chlorophenyl-boronic acid
4-chlorobenzene boronic acid
(4-chlorophenyl)boronicacid
4-Chlorophenylboronic acid, 95%
NSC 25408
AC-3320
Q-102202
4-chloro-benzeneboronic acid
NSC25408
[4-chloro-phenyl]-boronic acid
4-chlorophenyboronic acid

MDL Number

MFCD00039137

Customs Code

29319090

FAQ

What is (4-Chlorophenyl)boronic acid (CAS: 1679-18-1)?

(4-Chlorophenyl)boronic acid, with the CAS number 1679-18-1, is an organic compound that contains a boronic acid group attached to a 4-chlorophenyl ring. It is a white crystalline solid with a molecular formula of C7H7ClBO2 and is known for its reactivity in various chemical reactions, particularly in Suzuki coupling and other transition metal-catalyzed processes. This compound is commonly used in synthetic chemistry due to its functional group versatility.

What are the main uses of (4-Chlorophenyl)boronic acid (CAS: 1679-18-1)?

(4-Chlorophenyl)boronic acid (CAS: 1679-18-1) is primarily used in pharmaceutical research for the synthesis of various drugs and bioactive compounds. It also finds applications in industrial chemical processes, particularly in the development of materials and intermediates. In research settings, it serves as a key reagent in organic synthesis and catalytic reactions, making it valuable for creating complex molecules with specific functionalities.

Is (4-Chlorophenyl)boronic acid (CAS: 1679-18-1) safe?

While (4-Chlorophenyl)boronic acid (CAS: 1679-18-1) is generally considered safe when handled properly, it should be treated with caution. It is advisable to use appropriate personal protective equipment (PPE) such as gloves and goggles to avoid skin contact or inhalation. Although it is not classified as highly toxic, it is important to follow standard safety protocols and storage guidelines to ensure safe handling in laboratories and industrial environments.

How should (4-Chlorophenyl)boronic acid (CAS: 1679-18-1) be stored?

(4-Chlorophenyl)boronic acid (CAS: 1679-18-1) should be stored in a cool, dry, and well-ventilated area away from direct light. It is recommended to keep it in a sealed container to prevent moisture absorption and maintain stability. Proper storage conditions include temperatures below 25°C and low humidity levels to avoid degradation and ensure long-term usability.