(6-Cyano-3-pyridinyl)boronic acid

Basic Information

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CAS Number

1011722-07-8

Molecular Formula

C6H5BN2O2

Molecular Weight

17.03 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Nitriles

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Basic Physical Properties

SMILES

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N#Cc1ccc(cn1)B(O)O

InChI

InChI=1S/C6H5BN2O2/c8-3-6-2-1-5(4-9-6)7(10)11/h1-2,4,10-11H

InChIKey

JRWBBVDYZMMZOH-UHFFFAOYSA-N

LogP

0.16199999999999998

Topological Polar Surface Area

35.0 Å²

Hydrogen Bond Donor/Acceptor

3 / 1

Complexity

177

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

(6-Cyanopyridin-3-yl)boronic acid
2-Cyanopyridine-5-boronic acid
6-Cyanopyridine-3-boronic acid
5-dihydroxyborylpyridine-2-carbonitrile
(6-Cyanopyridin-3-yl)
5-Boronopicolinonitrile
2-cyano-5-pyridine boronic acid
(6-Cyano-3-pyridinyl)boronic acid
B-(6-Cyano-3-pyridinyl)boronic acid
6-cyanopyridin-3-ylboronic acid
Boronic acid, B-(6-cyano-3-pyridinyl)-
2-cyanopyridine 5-boronic acid
6-cyano-3-pyridineboronic acid
(6-cyano-3-pyridyl)boronic acid
JRWBBVDYZMMZOH-UHFFFAOYSA-N
BCP14609
RB2051
6-CYANOPYRIDIN-3-YLBORONICACID
LS20194
(6-cyanopyridin-3-yl)boronic acid

MDL Number

MFCD10696633

Customs Code

2933399090

FAQ

What are the physical and chemical properties of (6-Cyano-3-pyridinyl)boronic acid (CAS: 1011722-07-8)?

(6-Cyano-3-pyridinyl)boronic acid is a crystalline solid with a molecular weight of approximately 233.12 g/mol. It has a melting point of 216-218°C and is slightly soluble in water. The compound shows reactivity towards nucleophiles and can participate in various chemical reactions, such as in organic synthesis and catalytic processes.

How is (6-Cyano-3-pyridinyl)boronic acid (CAS: 1011722-07-8) typically synthesized?

(6-Cyano-3-pyridinyl)boronic acid can be synthesized through the reaction of 3-pyridylboronic acid with cyanoacetic acid under appropriate conditions. Common methods include the use of stoichiometric amounts of base and heat to promote the reaction. The yield and selectivity can be optimized by adjusting the reaction conditions such as temperature and solvent.

What industries use (6-Cyano-3-pyridinyl)boronic acid (CAS: 1011722-07-8)?

(6-Cyano-3-pyridinyl)boronic acid is utilized in various industries, including pharmaceuticals, where it serves as a building block for drug synthesis, and in polymer chemistry, where it can be incorporated into polymer structures to enhance properties. It also finds applications in sensor technology and semiconductor manufacturing.

What precautions should be taken when handling (6-Cyano-3-pyridinyl)boronic acid (CAS: 1011722-07-8)?

When handling (6-Cyano-3-pyridinyl)boronic acid, it is essential to use appropriate personal protective equipment (PPE) such as gloves and safety goggles. Work should be conducted in a well-ventilated area or a fume hood to minimize inhalation risks. Spills should be cleaned up using appropriate environmental agents, and it is advisable to consult the Safety Data Sheet (SDS) for detailed instructions on handling and disposal.