6-Bromo-2-chloro-3-methoxyphenylboronic acid

Basic Information

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CAS Number

957062-55-4

Molecular Formula

C7H7BBrClO3

Molecular Weight

265.3 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Ethers

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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B(C1=C(C=CC(=C1Cl)OC)Br)(O)O

InChI

InChI=1S/C7H7BBrClO3/c1-13-5-3-2-4(9)6(7(5)10)8(11)12/h2-3,11-12H,1H3

InChIKey

YITPGJUOVXQLPQ-UHFFFAOYSA-N

LogP

0.7908999999999997

Topological Polar Surface Area

49.69 Å²

Hydrogen Bond Donor/Acceptor

2 / 3

Complexity

172

Synonyms & References

English

(6-Bromo-2-chloro-3-methoxyphenyl)boronic acid
2-Chloro-3-methoxy-6-bromophenylboronic acid
6-Bromo-2-chloro-3-methoxyphenylboronic acid
(6-bromo-2-chloro-3-methoxy-phenyl)boronic acid
SBB071286
OR11674
FCH1393460
VB10104
AB0043275
AX8196759
Z1180
ST24034905
A845402
062B554
(6-bromanyl-2-chloranyl-3-methoxy-phenyl)boronic acid
B-(6-Bromo-2-chloro-3-methoxyphenyl)boronic acid (ACI)
(6-Bromo-2-chloro-3-methoxyphenyl)boronicacid
2-chloro-3-methoxy-6-bromophenylboronic acid
6-BROMO-2-CHLORO-3-METHOXYBENZENEBORONIC ACID
W16734
DTXSID30656913
J-518319
(6-bromo-2-chloro-3-methoxyphenyl)boronic acid
957062-55-4
DS-14942
CS-0038595
AKOS015835340
MFCD09800872
DB-029222

MDL Number

MFCD09800872

Customs Code

2931900090

FAQ

What is 6-Bromo-2-chloro-3-methoxyphenylboronic acid (CAS: 957062-55-4)?

6-Bromo-2-chloro-3-methoxyphenylboronic acid is an organoboronic acid compound with the CAS number 957062-55-4. It is a white or off-white powder with a molecular formula of C9H7BrClO3B and a molecular weight of approximately 301.04 g/mol. This compound is known for its reactivity in organic synthesis, particularly in the formation of C-C bonds in cross-coupling reactions.

What are the main uses of 6-Bromo-2-chloro-3-methoxyphenylboronic acid (CAS: 957062-55-4)?

6-Bromo-2-chloro-3-methoxyphenylboronic acid is primarily used as a key intermediate in the synthesis of pharmaceuticals, particularly in the development of anti-inflammatory and antiviral drugs. It is also utilized in the preparation of functional materials and in academic research for the study of organoboronic acid chemistry and catalytic reactions.

Is 6-Bromo-2-chloro-3-methoxyphenylboronic acid (CAS: 957062-55-4) safe?

6-Bromo-2-chloro-3-methoxyphenylboronic acid is generally considered safe for laboratory use when proper precautions are followed. It is important to handle the compound in a well-ventilated area, using appropriate personal protective equipment such as gloves and goggles. Avoid contact with eyes and skin, and ensure good laboratory hygiene practices.

How should 6-Bromo-2-chloro-3-methoxyphenylboronic acid (CAS: 957062-55-4) be stored?

6-Bromo-2-chloro-3-methoxyphenylboronic acid should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly sealed, amber-colored container to protect it from light. The temperature should be maintained below 30°C to prevent degradation. It is also advisable to store it in a fume hood or well-ventilated area to minimize the risk of exposure.