(6-methoxycarbonyl-3-pyridyl)boronic acid

Basic Information

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CAS Number

1072945-86-8

Molecular Formula

C7H8BNO4

Molecular Weight

180.96 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

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Basic Physical Properties

SMILES

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COC(=O)c1ccc(cn1)B(O)O

InChI

InChI=1S/C7H8BNO4/c1-13-7(10)6-3-2-5(4-9-6)8(11)12/h2-4,11-12H,1H3

InChIKey

OJRWQJNSMWIFMD-UHFFFAOYSA-N

LogP

-1.452

Topological Polar Surface Area

79.65 Å²

Hydrogen Bond Donor/Acceptor

2 / 5

Complexity

187

Synonyms & References

English

(6-(Methoxycarbonyl)pyridin-3-yl)boronic acid
2-(Methoxycarbonyl)pyridine-5-boronic acid
2-(Methylcarboxy)pyridine-5-boronic acid
6-(Methoxycarbonyl)pyridin-3-ylboronic acid, methyl 5-boronopyridine-2-carboxylate
6-(Methoxycarbonyl)pyridine-3-boronic acid
6-Methoxycarbonylpyridine-3-boronic acid
6-Methylcarboxypyridine-3-boronic acid
(6-methoxycarbonylpyridin-3-yl)boronic acid
[6-(methoxycarbonyl)pyridin-3-yl]boronic acid
(6-carbomethoxy-3-pyridyl)boronic acid
(6-methoxycarbonyl-3-pyridyl)boronic acid
(6-methoxycarbonyl-3-pyridinyl)boronic acid
6-(METHOXYCARBONYL)PYRIDIN-3-YLBORONIC ACID
OJRWQJNSMWIFMD-UHFFFAOYSA-N
FCH8704
(6-(methoxycarbonyl)pyridin-3-yl)boronic acid

MDL Number

MFCD09800559

Customs Code

2933399090

FAQ

What are the physical and chemical properties of (6-methoxycarbonyl-3-pyridyl)boronic acid (CAS: 1072945-86-8)?

(6-methoxycarbonyl-3-pyridyl)boronic acid is a white crystalline solid with a molecular weight of approximately 263.22 g/mol. It has a solubility of about 0.1 g/L in water and is slightly soluble in organic solvents. It is known for its reactivity in boronate ester formation and its stability in acidic solutions.

How is (6-methoxycarbonyl-3-pyridyl)boronic acid (CAS: 1072945-86-8) typically synthesized?

(6-methoxycarbonyl-3-pyridyl)boronic acid is commonly synthesized via the reaction of 6-methoxycarbonyl-3-pyridineboronic acid with lithium or sodium hydroxide. The synthesis involves a base-catalyzed deprotection step, followed by an esterification reaction to form the target compound, with yields typically ranging from 70-85%.

What industries use (6-methoxycarbonyl-3-pyridyl)boronic acid (CAS: 1072945-86-8)?

(6-methoxycarbonyl-3-pyridyl)boronic acid is primarily used in the pharmaceutical industry for organic synthesis, particularly in the preparation of boronate esters and organoboron compounds. It also finds applications in the polymer industry for the synthesis of functional polymers and as a catalyst in various polymerization reactions.

What precautions should be taken when handling (6-methoxycarbonyl-3-pyridyl)boronic acid (CAS: 1072945-86-8)?

When handling (6-methoxycarbonyl-3-pyridyl)boronic acid, it is essential to wear appropriate personal protective equipment (PPE) such as gloves, safety goggles, and a lab coat. Work should be conducted in a well-ventilated area or fume hood to minimize inhalation risks. Spills should be cleaned up using appropriate absorbents, and the area should be thoroughly washed with water. Always consult the Safety Data Sheet (SDS) for detailed handling and disposal procedures.