3-Benzoyl-2-pyridinecarboxylic acid

Basic Information

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CAS Number

64362-32-9

Molecular Formula

C13H9NO3

Molecular Weight

227.22 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Basic Physical Properties

Physical State

Yellow to Brown Solid

Melting Point

151-155 °C

SMILES

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C1=CC=C(C=C1)C(=O)C2=C(N=CC=C2)C(=O)O

InChI

InChI=1S/C13H9NO3/c15-12(9-5-2-1-3-6-9)10-7-4-8-14-11(10)13(16)17/h1-8H,(H,16,17)

InChIKey

YERHKEWRHQIXFY-UHFFFAOYSA-N

LogP

2.0107999999999997

Topological Polar Surface Area

67.25999999999999 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

297

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

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

64362-32-9
CS-0171245
Maybridge3_000526
3-benzoylpyridin-2-carboxylic acid
DTXSID40352454
beta-Benzoylpicolinsaure
HMS1432H20
2-Carboxy-3-benzoylpyridine
MFCD00209545
AC-907/30063051
3-Benzoylpicolinicacid
3-Benzoyl-2-pyridinecarboxylic acid
3-Benzoylpyridine-2-carboxylic acid, 98%
CCG-47095
SR-01000636742-1
benzoyl-pyridine-carboxylic acid
IDI1_011913
SCHEMBL296670
AKOS022172362
3-benzoyl pyridine-2-carboxylic acid
3-Benzoyl-pyridine-2-carboxylic acid
YERHKEWRHQIXFY-UHFFFAOYSA-N
3-Benzoylpicolinic acid
Oprea1_551417
AS-36389
3-Benzoylpyridine-2-carboxylic acid
FT-0615091
2-Pyridinecarboxylicacid, 3-benzoyl-
3-Benzoyl-2-Pyridinecarboxylic Acid
3-benzoylpyridine-2-carboxylic acid
3-Benzoylpikolinsaeure

MDL Number

MFCD00209545

FAQ

What are the physical and chemical properties of 3-Benzoyl-2-pyridinecarboxylic acid (CAS: 64362-32-9)?

3-Benzoyl-2-pyridinecarboxylic acid is a crystalline solid with a molecular weight of approximately 248.24 g/mol. It has a low solubility in water (0.04 g/100 mL at 20°C) but is more soluble in organic solvents like ethanol and acetone. This compound is known for its high reactivity, particularly towards nucleophilic substitution and condensation reactions.

How is 3-Benzoyl-2-pyridinecarboxylic acid (CAS: 64362-32-9) typically synthesized?

3-Benzoyl-2-pyridinecarboxylic acid can be synthesized through the condensation of 2-pyridinecarboxylic acid and benzoic anhydride in the presence of a Lewis acid catalyst like aluminum trichloride. The reaction is exothermic and yields a high purity product with good selectivity and moderate to high yield.

What industries use 3-Benzoyl-2-pyridinecarboxylic acid (CAS: 64362-32-9)?

3-Benzoyl-2-pyridinecarboxylic acid is used in various industries, including pharmaceuticals, where it serves as an intermediate in the synthesis of certain drugs. It is also relevant in the manufacturing of polymers, sensors, and semiconductors due to its chemical reactivity and structural properties.

What precautions should be taken when handling 3-Benzoyl-2-pyridinecarboxylic acid (CAS: 64362-32-9)?

When handling 3-Benzoyl-2-pyridinecarboxylic acid (CAS: 64362-32-9), it is crucial to wear appropriate personal protective equipment (PPE) such as gloves, goggles, and a laboratory coat. Work in a well-ventilated area or a fume hood to avoid inhalation. In case of a spill, immediately clean up using appropriate materials and follow the safety data sheet (SDS) for further instructions. Proper disposal of waste should be in accordance with local regulations.