[3-Methoxy-4-(methoxycarbonyl)phenyl]boronic acid

Basic Information

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CAS Number

603122-41-4

Molecular Formula

C9H11BO5

Molecular Weight

209.99 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

Boiling Point

397.374 °C at 760 mmHg

Density

1.27

Flash Point

397.374 °C at 760 mmHg

Refractive Index

1.526

SMILES

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

InChI

InChI=1S/C9H11BO5/c1-14-8-5-6(10(12)13)3-4-7(8)9(11)15-2/h3-5,12-13H,1-2H3

InChIKey

YCXPWNGIPLGCOJ-UHFFFAOYSA-N

LogP

-0.8384000000000003

Topological Polar Surface Area

75.99000000000001 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

221

Safety Information

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Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

[3-methoxy-4-(methoxycarbonyl)phenyl]-boronic acid
W10573
DTXSID00590390
AC-26878
(3-methoxy-4(methoxycarbonyl)phenyl) boronic acid
3-methoxy-4-methoxycarbonylphenyl boronic acid
1216665-42-7
4-Methoxycarbonyl-3-methoxyphenylboronic acid, AldrichCPR
(3-methoxy-4-(methoxycarbonyl) phenyl) boronic acid
SCHEMBL189207
FT-0678860
MFCD07366483
PS-9508
SY107009
4-Methoxycarbonyl-3-methoxyphenylboronic acid
3-methoxy-4-(methoxycarbonyl)phenylboronic acid
CS-0047532
AB30928
AKOS015851430
(3-methoxy-4-(methoxycarbonyl)phenyl)boronic acid
A26177
EN300-7357309
(3-methoxy-4-methoxycarbonylphenyl)boronic acid
3-METHOXY-4-METHOXYCARBONYLPHENYLBORONICACID
AM804120
3-Methoxy-4-(methoxycarbonyl)benzeneboronic acid
YCXPWNGIPLGCOJ-UHFFFAOYSA-N
[3-methoxy-4-(methoxycarbonyl)phenyl]boronic acid
603122-41-4
(3-methoxy-4-methoxycarbonyl-phenyl)boronic acid
3-METHOXY-4-METHOXYCARBONYLPHENYLBORONIC ACID

MDL Number

MFCD07366483

Customs Code

2931900090

FAQ

What are the physical and chemical properties of [3-Methoxy-4-(methoxycarbonyl)phenyl]boronic acid (CAS: 603122-41-4)?

[3-Methoxy-4-(methoxycarbonyl)phenyl]boronic acid (CAS: 603122-41-4) is a white crystalline solid with a molecular weight of approximately 257.28 g/mol. It is slightly soluble in water but more soluble in organic solvents like methanol and acetonitrile. The compound is reactive towards nucleophiles and can undergo various organic reactions such as esterification and nucleophilic addition.

How is [3-Methoxy-4-(methoxycarbonyl)phenyl]boronic acid (CAS: 603122-41-4) typically synthesized?

[3-Methoxy-4-(methoxycarbonyl)phenyl]boronic acid (CAS: 603122-41-4) can be synthesized via the coupling of 4-bromophenylboronic acid with 3-methoxybenzoyl chloride in the presence of a base such as potassium carbonate and a solvent like dimethylformamide. The reaction is typically carried out at room temperature, and the yield can be up to 85% depending on the reaction conditions.

What industries use [3-Methoxy-4-(methoxycarbonyl)phenyl]boronic acid (CAS: 603122-41-4)?

[3-Methoxy-4-(methoxycarbonyl)phenyl]boronic acid (CAS: 603122-41-4) is commonly used in the pharmaceutical industry for drug synthesis and in the polymer industry for the modification of polymers. It also finds applications in sensor technology and semiconductor manufacturing due to its reactive properties.

What precautions should be taken when handling [3-Methoxy-4-(methoxycarbonyl)phenyl]boronic acid (CAS: 603122-41-4)?

When handling [3-Methoxy-4-(methoxycarbonyl)phenyl]boronic acid (CAS: 603122-41-4), it is important to use personal protective equipment such as gloves and safety glasses. The compound should be handled in a well-ventilated area or a fume hood to avoid inhalation. Spills should be cleaned up carefully, and proper disposal methods should be followed. Always consult the Safety Data Sheet (SDS) for specific handling and safety information.