2-Chloro-5-(methoxycarbonyl)benzoic acid

Basic Information

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CAS Number

651058-97-8

Molecular Formula

C9H7ClO4

Molecular Weight

214.6 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

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

SMILES

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COC(=O)C1=CC(=C(C=C1)Cl)C(=O)O

InChI

InChI=1S/C9H7ClO4/c1-14-9(13)5-2-3-7(10)6(4-5)8(11)12/h2-4H,1H3,(H,11,12)

InChIKey

YHXPAIMKXLFOOT-UHFFFAOYSA-N

LogP

1.8247999999999998

Topological Polar Surface Area

63.60000000000001 Å²

Hydrogen Bond Donor/Acceptor

1 / 4

Complexity

241

Synonyms & References

English

1,3-Benzenedicarboxylic acid, 4-chloro-, 1-methyl ester
DS-12002
MFCD22491082
EN300-215728
2-chloro-5-(methoxycarbonyl)benzoicacid
651058-97-8
SCHEMBL1929461
2-chloro-5-(methoxycarbonyl)benzoic acid
BBB05897
AKOS027322778
FT-0716129
2-chloro-5-methoxycarbonylbenzoic acid
2-chloro-5-methoxycarbonylbenzoate
2-chloro-5-(methoxycarbonyl)benzoic
AK314219
Z2130643424

MDL Number

MFCD22491082

FAQ

What is 2-Chloro-5-(methoxycarbonyl)benzoic acid (CAS: 651058-97-8)?

2-Chloro-5-(methoxycarbonyl)benzoic acid (CAS: 651058-97-8) is an organic compound with the molecular formula C9H7ClO4. It is a white or off-white crystalline solid with a pungent odor. This compound is used in pharmaceuticals, research, and industry for various applications due to its chemical properties.

What are the main uses of 2-Chloro-5-(methoxycarbonyl)benzoic acid (CAS: 651058-97-8)?

2-Chloro-5-(methoxycarbonyl)benzoic acid (CAS: 651058-97-8) is primarily used in pharmaceuticals for the synthesis of medicinal compounds. It is also utilized in research and industry for its chemical reactivity and stability. Additionally, it has applications in the formulation of certain industrial products and as a reagent in organic synthesis.

Is 2-Chloro-5-(methoxycarbonyl)benzoic acid (CAS: 651058-97-8) safe?

2-Chloro-5-(methoxycarbonyl)benzoic acid (CAS: 651058-97-8) is generally safe when handled with appropriate precautions. However, it is important to follow safety guidelines, including wearing protective clothing, gloves, and eyewear. It should be stored away from sources of heat and open flames to prevent degradation and ensure safety.

How should 2-Chloro-5-(methoxycarbonyl)benzoic acid (CAS: 651058-97-8) be stored?

2-Chloro-5-(methoxycarbonyl)benzoic acid (CAS: 651058-97-8) should be stored in a cool, dry place, away from direct sunlight and sources of heat. It should be kept in a tightly sealed container to prevent moisture absorption. Proper storage conditions are essential to maintain its chemical stability and ensure safe handling.