[4-(Methoxycarbonyl)phenyl]boronic acid

Basic Information

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CAS Number

99768-12-4

Molecular Formula

C8H9BO4

Molecular Weight

179.97 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

Melting Point

234°C

Boiling Point

345.8°C at 760 mmHg

Density

1.2500

Flash Point

162.9℃

Solubility

Soluble in methanol.

Refractive Index

1.532

SMILES

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

InChI

InChI=1S/C8H9BO4/c1-13-8(10)6-2-4-7(5-3-6)9(11)12/h2-5,11-12H,1H3

InChIKey

PQCXFUXRTRESBD-UHFFFAOYSA-N

LogP

-0.8470000000000002

Topological Polar Surface Area

66.76 Å²

Hydrogen Bond Donor/Acceptor

2 / 4

Complexity

175

Safety Information

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Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

4-Methoxycarbonylphenylboronic acid
Methyl 4-boronobenzoate
Methyl 4-(Dihydroxyboranyl)Benzoate
(4-(methoxycarbonyl)phenyl) boronic acid
HY-W003977
4-(Methoxycarbonyl)phenylboronic acid
4-(carbomethoxy)phenylboronic acid
PQCXFUXRTRESBD-UHFFFAOYSA-N
(4-Methoxycarbonylphenyl)boronic acid
4-methoxycarbonyl phenylboronic acid
p-methoxycarbonylphenylboronic acid
4-(Methoxycarbonyl)phenyl boronic acid
AM62784
Z1095162714
BP-11412
p-(methoxycarbonyl)phenylboronic acid
4-methoxycarbonylphenyl boronic acid
4-methoxycarbonyl-phenyl boronic acid
4-(methoxycarbonyl) phenyl boronic acid
(4-(Methoxycarbonyl)phenyl)boronicacid
J-515664
4-methoxycarbonyl-phenylboronic acid
4-(methoxycarbonyl) phenylboronic acid
99768-12-4
[4-(methoxycarbonyl)phenyl]boronic acid
(4-methoxycarbonylphenyl)-boronic acid
AB09470
4-(methoxycarbonyl)-phenylboronic acid
4-(methoxycarbonyl)phenyl-boronic acid
4-methoxycarbonylphenyl-boronic acid
[4-(methoxycarbonyl)-phenyl]boronic acid

MDL Number

MFCD01632203

Customs Code

2931900090

FAQ

What is [4-(Methoxycarbonyl)phenyl]boronic acid (CAS: 99768-12-4)?

[4-(Methoxycarbonyl)phenyl]boronic acid, with CAS number 99768-12-4, is an organic compound containing a boronic acid functional group attached to a phenyl ring. It has the chemical formula C10H11BO3O2 and is known for its reactivity in chemical synthesis. The compound is often used as a building block in pharmaceutical and materials science applications due to its ability to participate in various reactions such as Suzuki coupling.

What are the main uses of [4-(Methoxycarbonyl)phenyl]boronic acid (CAS: 99768-12-4)?

[4-(Methoxycarbonyl)phenyl]boronic acid (CAS: 99768-12-4) is primarily used in pharmaceutical research for drug development, particularly in the synthesis of bioactive molecules. It also finds applications in organic chemistry as a versatile intermediate for creating complex structures. Additionally, it has potential uses in materials science for developing new polymers and functional materials.

Is [4-(Methoxycarbonyl)phenyl]boronic acid (CAS: 99768-12-4) safe?

[4-(Methoxycarbonyl)phenyl]boronic acid (CAS: 99768-12-4) is generally considered safe when handled properly. However, it should be treated with care as it may cause skin and eye irritation. Safety standards recommend using appropriate personal protective equipment (PPE) such as gloves and goggles. It is important to follow safe chemical handling practices to avoid exposure and ensure a safe working environment.

How should [4-(Methoxycarbonyl)phenyl]boronic acid (CAS: 99768-12-4) be stored?

[4-(Methoxycarbonyl)phenyl]boronic acid (CAS: 99768-12-4) should be stored in a cool, dry place away from direct light. It is best kept in a sealed container to prevent moisture absorption. Storage conditions should maintain a temperature below 25°C and a relative humidity level below 60% to ensure stability and prolong shelf life. Always store in a well-ventilated area to minimize risks associated with chemical exposure.