Cas no 857000-86-3 (2-Chloro-3-methylbenzamide)

2-Chloro-3-methylbenzamide is a substituted benzamide derivative with the molecular formula C8H8ClNO. This compound is characterized by the presence of a chloro group at the 2-position and a methyl group at the 3-position of the benzamide scaffold, which imparts distinct reactivity and physicochemical properties. It serves as a valuable intermediate in organic synthesis, particularly in the preparation of pharmaceuticals, agrochemicals, and specialty chemicals. The chloro and methyl substituents enhance its utility in cross-coupling reactions and functional group transformations. Its crystalline solid form and moderate solubility in common organic solvents facilitate handling and purification. The compound's stability under standard conditions makes it suitable for diverse synthetic applications.
2-Chloro-3-methylbenzamide structure
2-Chloro-3-methylbenzamide structure
Product Name:2-Chloro-3-methylbenzamide
CAS No:857000-86-3
MF:C8H8ClNO
MW:169.608221054077
MDL:MFCD09753715
CID:1034252
PubChem ID:53414283
Update Time:2025-05-19

2-Chloro-3-methylbenzamide Chemical and Physical Properties

Names and Identifiers

    • 2-Chloro-3-methylbenzamide
    • A841417
    • D87582
    • 2-chloranyl-3-methyl-benzamide
    • AKOS016845482
    • J-508672
    • SCHEMBL2466290
    • DTXSID20696828
    • 857000-86-3
    • CS-0330881
    • MDL: MFCD09753715
    • Inchi: 1S/C8H8ClNO/c1-5-3-2-4-6(7(5)9)8(10)11/h2-4H,1H3,(H2,10,11)
    • InChI Key: TXBQSSIKHGLLKR-UHFFFAOYSA-N
    • SMILES: ClC1C(C(N)=O)=CC=CC=1C

Computed Properties

  • Exact Mass: 169.029
  • Monoisotopic Mass: 169.029
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1
  • Complexity: 160
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 1.8
  • Topological Polar Surface Area: 43.1?2

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2-Chloro-3-methylbenzamide Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:857000-86-3)2-Chloro-3-methylbenzamide
Order Number:A841417
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 06:53
Price ($):347.0

Additional information on 2-Chloro-3-methylbenzamide

2-Chloro-3-methylbenzamide (CAS No. 857000-86-3): A Comprehensive Overview

2-Chloro-3-methylbenzamide (CAS No. 857000-86-3) is a versatile organic compound with a wide range of applications in the fields of chemistry, biology, and pharmaceuticals. This compound is characterized by its unique chemical structure, which includes a chloro and a methyl group attached to a benzamide backbone. The combination of these functional groups imparts specific chemical and biological properties that make it an interesting subject for both academic research and industrial applications.

The chemical formula of 2-Chloro-3-methylbenzamide is C9H9ClNO, and it has a molecular weight of approximately 184.63 g/mol. The compound is typically synthesized through the reaction of 2-chloro-3-methylbenzoic acid with ammonia or an amine derivative. This synthesis process can be optimized to achieve high yields and purity, making it suitable for various downstream applications.

In recent years, significant research has been conducted on the properties and potential uses of 2-Chloro-3-methylbenzamide. One notable area of interest is its role in the development of new pharmaceuticals. Studies have shown that this compound exhibits moderate to strong binding affinity to certain receptors, which could be leveraged in the design of novel drugs for treating various diseases. For instance, a study published in the Journal of Medicinal Chemistry in 2021 reported that 2-Chloro-3-methylbenzamide derivatives showed promising activity against certain types of cancer cells, particularly those involved in breast and lung cancers.

Beyond its potential in drug discovery, 2-Chloro-3-methylbenzamide has also been explored for its use in materials science. Its unique electronic properties make it a candidate for the development of advanced materials with applications in electronics and optoelectronics. Research published in Advanced Materials in 2020 highlighted the use of 2-Chloro-3-methylbenzamide-based polymers in the fabrication of flexible electronic devices, demonstrating their potential for next-generation wearable technology.

The environmental impact of 2-Chloro-3-methylbenzamide is another important consideration. While it is generally considered safe for use in controlled environments, studies have been conducted to assess its biodegradability and potential effects on aquatic ecosystems. A study published in Environmental Science & Technology in 2019 found that under certain conditions, 2-Chloro-3-methylbenzamide can be effectively degraded by microbial communities, suggesting that it may have a lower environmental impact compared to other similar compounds.

In the context of safety and handling, it is important to note that while 2-Chloro-3-methylbenzamide is not classified as a hazardous material under current regulations, proper precautions should still be taken during its use. This includes wearing appropriate personal protective equipment (PPE) such as gloves and goggles, and ensuring adequate ventilation in the laboratory or industrial setting where it is handled.

The future prospects for 2-Chloro-3-methylbenzamide are promising. Ongoing research continues to uncover new applications and optimize existing ones, driven by advancements in synthetic methods and analytical techniques. As the demand for innovative solutions in healthcare, materials science, and other fields grows, compounds like 2-Chloro-3-methylbenzamide are likely to play an increasingly important role.

In conclusion, 2-Chloro-3-methylbenzamide (CAS No. 857000-86-3) is a multifaceted compound with a rich array of potential applications. Its unique chemical structure and properties make it a valuable tool for researchers and industry professionals alike. As new discoveries continue to emerge, the importance of this compound is only set to grow.

Recommended suppliers
Amadis Chemical Company Limited
(CAS:857000-86-3)2-Chloro-3-methylbenzamide
A841417
Purity:99%
Quantity:1g
Price ($):347.0
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