(4-Methylstyryl)boronic acid

Basic Information

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CAS Number

72316-17-7

Molecular Formula

C9H11BO2

Molecular Weight

162 g/mol

Chemical Classification

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

169-175 °C

Boiling Point

330.9°C at 760 mmHg

Density

1.1

Flash Point

154°C

Refractive Index

1.578

SMILES

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B(C=CC1=CC=C(C=C1)C)(O)O

InChI

InChI=1S/C9H11BO2/c1-8-2-4-9(5-3-8)6-7-10(11)12/h2-7,11-12H,1H3

InChIKey

JJOBVKVXRDHVRP-UHFFFAOYSA-N

LogP

1.02022

Topological Polar Surface Area

40.46 Å²

Hydrogen Bond Donor/Acceptor

2 / 2

Complexity

149

Safety Information

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Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

A866287
(E)-(4-Methylstyryl)boronic acid
(E)-2-(4-methylphenyl)ethenylboronic acid
AKOS015893172
PD182279
JJOBVKVXRDHVRP-VOTSOKGWSA-N
trans-2-(4-Methylphenyl)vinylboronic acid
(E)-(4-Methylstyryl)boronicacid
(4-Methylstyryl)boronic acid
MFCD03427284
4-methylstyrylboronic acid
XCA31617
[(E)-2-(4-methylphenyl)vinyl]boronic acid
trans-2-(4-Methylphenyl)vinylboronic acid, 97%
BDBM50294579
[(E)-2-(4-methylphenyl)ethenyl]boronic acid
Boronic acid, [(1E)-2-(4-methylphenyl)ethenyl]-
CS-0110015
AS-59622
72316-17-7
CHEMBL551649
SCHEMBL350162
[2-(4-methylphenyl)ethenyl]boronic acid
Boronic acid,B-[(1E)-2-(4-methylphenyl)ethenyl]-
Trans-2-(4-methylphenyl)vinylboronic acid
(E)-(4-methylstyryl)boronic acid
(E)-2-(4-methylphenyl)-vinylboronic acid
1-(4-Methylphenyl)-vinyl-2-boronic acid
trans-2-(4-methyl)phenylvinylboronic acid
TRANS-2-(4-METHYLPHENYL)VINYLBORONIC AC&E-2-(p-tolyl)ethenylboronic acid
TRANS-2-(4-METHYLPHENYL)VINYLBORONIC AC&

MDL Number

MFCD03427284

Customs Code

2931900090

FAQ

What regulatory guidelines apply to (4-Methylstyryl)boronic acid (CAS: 72316-17-7)?

Regulatory guidelines for (4-Methylstyryl)boronic acid (CAS: 72316-17-7) include REACH regulations in the European Union, which covers registration, evaluation, authorization, and restriction of chemicals. Additionally, it may fall under the Global Harmonized System (GHS) for classification and labeling of chemicals. In the USA, it might be subject to EPA regulations for environmental protection and FDA for pharmaceutical applications. Always consult the latest regulatory documents for specific requirements.

Are there alternatives to (4-Methylstyryl)boronic acid (CAS: 72316-17-7) in synthesis?

Alternatives to (4-Methylstyryl)boronic acid (CAS: 72316-17-7) include other boronic acids such as phenylboronic acid or methylboronic acid. Isomers like 2-Methylstyrylboronic acid can also be considered. Synthesizers may opt for these depending on the reactivity and availability. Always consider the specific reaction conditions and desired product purity when selecting an alternative.

What is the market or research trend for (4-Methylstyryl)boronic acid (CAS: 72316-17-7)?

The market for (4-Methylstyryl)boronic acid (CAS: 72316-17-7) is growing due to its applications in organic synthesis, particularly in Suzuki coupling reactions. Research trends focus on its use in drug discovery, polymer synthesis, and materials science. However, market dynamics can vary, so staying updated with industry reports and scientific journals is essential.

How should waste containing (4-Methylstyryl)boronic acid (CAS: 72316-17-7) be handled?

Waste containing (4-Methylstyryl)boronic acid (CAS: 72316-17-7) should be collected in appropriate containers and disposed of through professional waste disposal services. Incineration is a common method for disposal, but ensure it is done in a manner compliant with environmental regulations. Always refer to the Material Safety Data Sheet (MSDS) and local waste management guidelines for specific handling instructions.