4-(Methylsulfonyl)phenylboronic Acid

Basic Information

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CAS Number

149104-88-1

Molecular Formula

C7H9BO4S

Molecular Weight

200.02 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

289-293 °C

Boiling Point

445.5°C at 760 mmHg

Density

1.39

Flash Point

223.2℃

Refractive Index

1.566

SMILES

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

InChI

InChI=1S/C7H9BO4S/c1-13(11,12)7-4-2-6(3-5-7)8(9)10/h2-5,9-10H,1H3

InChIKey

VDUKDQTYMWUSAC-UHFFFAOYSA-N

LogP

-1.2301

Topological Polar Surface Area

74.60000000000001 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

248

Safety Information

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GHS Hazard Pictograms

H315

H319

H335

Hazard Statement

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

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

DTXSID40370254
VDUKDQTYMWUSAC-UHFFFAOYSA-N
4-(METHYLSULPHONYL)PHENYLBORONIC ACID
HY-77642
4-methanesulfonylphenyl-boronic acid
[4-(methylsulfonyl)phenyl]-boronic acid
AB09317
4-(methansulfonyl)phenylboronic acid
NCGC00249481-01
4-methanesulfonylbenzeneboronic acid
4-methylsulfonyl-phenyl boronic acid
4-(methylsulfonyl)-phenylboronic acid
Z1269221371
(4-methanesulfonylphenyl)boronic acid
4-METHANSULFONYLPHENYLBORONIC ACID
(4-methane sulphonyl phenyl) boronic Acid
4-methylsulfonylphenyl boronic acid
AM20050271
4-(Methanesulfonyl)phenylboronic acid, >=95.0%
4-(methanesulfonyl)-phenyl boronic acid
AC-24825
M1972
4-(methylsulfonyl)-phenyl boronic acid
149104-88-1
[4-(methyl sulfonyl)phenyl]boronic acid
4-Methylsulfonylphenylboronic acid
4-methanesulphonyl benzene boronic acid
4-(Methylsulfonyl)phenylboronicacid
4-(methanesulfonyl)-phenylboronic acid
Boronic acid, [4-(methylsulfonyl)phenyl]-
4-(methylsulphonyl)-phenylboronic acid

MDL Number

MFCD01630820

Customs Code

2931900090

FAQ

What regulatory guidelines apply to 4-(Methylsulfonyl)phenylboronic Acid (CAS: 149104-88-1)?

4-(Methylsulfonyl)phenylboronic Acid (CAS: 149104-88-1) is regulated under the Globally Harmonized System of Classification and Labelling of Chemicals (GHS) as a hazardous chemical. It must comply with REACH regulations in the European Union, ensuring that manufacturers and importers register the substance with the European Chemicals Agency (ECHA). Additionally, the Food and Drug Administration (FDA) and Environmental Protection Agency (EPA) in the United States have specific labeling and reporting requirements for this compound.

Are there alternatives to 4-(Methylsulfonyl)phenylboronic Acid (CAS: 149104-88-1) in synthesis?

There are alternative reagents to 4-(Methylsulfonyl)phenylboronic Acid (CAS: 149104-88-1) that can be used in synthesis, such as 2-(Methylsulfonyl)phenylboronic acid or 4-(Trifluoromethyl)phenylboronic acid. These alternatives can offer similar functionalities and may be more readily available or cost-effective depending on the specific application.

What is the market or research trend for 4-(Methylsulfonyl)phenylboronic Acid (CAS: 149104-88-1)?

The market for 4-(Methylsulfonyl)phenylboronic Acid (CAS: 149104-88-1) is showing growth due to its applications in organic synthesis, particularly in the development of pharmaceuticals and agrochemicals. Research trends indicate increasing interest in utilizing this compound for its reactivity and stability in various reaction conditions. Additionally, there is a growing focus on its use in sustainable and green chemistry processes.

How should waste containing 4-(Methylsulfonyl)phenylboronic Acid (CAS: 149104-88-1) be handled?

Waste containing 4-(Methylsulfonyl)phenylboronic Acid (CAS: 149104-88-1) should be collected in appropriate containers with proper labeling, ensuring it is stored in a dry and well-ventilated area away from incompatible materials. For disposal, it is recommended to consult with a professional waste management service that specializes in hazardous waste. Proper incineration or chemical treatment may be necessary to ensure safe and environmentally compliant disposal.