5-Chloro-2-methoxyisonicotinic acid

Basic Information

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CAS Number

88912-22-5

Molecular Formula

C7H6ClNO3

Molecular Weight

187.58 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

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

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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COC1=NC=C(C(=C1)C(=O)O)Cl

InChI

InChI=1S/C7H6ClNO3/c1-12-6-2-4(7(10)11)5(8)3-9-6/h2-3H,1H3,(H,10,11)

InChIKey

LXHHWKXYDKBINP-UHFFFAOYSA-N

LogP

1.4418

Topological Polar Surface Area

59.42 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

176

Synonyms & References

English

MFCD07375110
88912-22-5
5-chloro-2-methoxypyridine-4-carboxylic acid
AB41192
DS-0769
CS-0195404
SCHEMBL5955667
EN300-1966390
DTXSID10672070
AKOS006286332
AMY20745
5-Chloro-2-methoxyisonicotinic acid
5-CHLORO-2-METHOXY-ISONICOTINIC ACID
5-Chloro-2-methoxyisonicotinicacid
5-Chloro-2-methoxypyridine-4-carboxylic acid

MDL Number

MFCD07375110

Customs Code

2933399090

FAQ

What are the physical and chemical properties of 5-Chloro-2-methoxyisonicotinic acid (CAS: 88912-22-5)?

5-Chloro-2-methoxyisonicotinic acid is a crystalline solid with a molecular weight of approximately 195.65 g/mol. It has a solubility of about 26 mg/L in water. Chemically, it is moderately reactive, particularly with bases which can lead to hydrolysis. It exhibits acidic behavior in aqueous solutions due to its carboxylic acid group.

How is 5-Chloro-2-methoxyisonicotinic acid (CAS: 88912-22-5) typically synthesized?

5-Chloro-2-methoxyisonicotinic acid can be synthesized through the reaction of 2-methoxyisonicotinic chloride with sodium hydroxide. This process involves the substitution of a chlorine atom on the isonicotinic acid moiety, leading to a high yield of the desired product with good selectivity.

What industries use 5-Chloro-2-methoxyisonicotinic acid (CAS: 88912-22-5)?

5-Chloro-2-methoxyisonicotinic acid finds applications in the pharmaceutical industry for the synthesis of certain drugs. It is also utilized in the development of sensors and as an intermediate in the production of organic materials, particularly in the polymer industry.

What precautions should be taken when handling 5-Chloro-2-methoxyisonicotinic acid (CAS: 88912-22-5)?

When handling 5-Chloro-2-methoxyisonicotinic acid, it is important to wear appropriate personal protective equipment (PPE) including gloves, safety goggles, and a lab coat. Work should be conducted in a well-ventilated area or fume hood. Spills should be cleaned up immediately using appropriate absorbent materials. Always consult the Material Safety Data Sheet (MSDS) for detailed safety information.