Cas no 62077-26-3 (3,6-dichloro-2-methylaniline)

3,6-dichloro-2-methylaniline structure
3,6-dichloro-2-methylaniline structure
Product Name:3,6-dichloro-2-methylaniline
CAS No:62077-26-3
MF:C7H7Cl2N
MW:176.043179750443
MDL:MFCD20699076
CID:458964
PubChem ID:59732208
Update Time:2025-04-25

3,6-dichloro-2-methylaniline Chemical and Physical Properties

Names and Identifiers

    • Benzenamine, 3,6-dichloro-2-methyl-
    • 3,6-dichloro-2-methylaniline
    • AS-46452
    • 3,6-Dichloro-2-methylbenzenamine
    • CL9671
    • SCHEMBL10083916
    • MFCD20699076
    • CS-0342996
    • AKOS027325271
    • 62077-26-3
    • DTXSID40732772
    • MDL: MFCD20699076
    • Inchi: 1S/C7H7Cl2N/c1-4-5(8)2-3-6(9)7(4)10/h2-3H,10H2,1H3
    • InChI Key: ZAQGLDMWELFZPL-UHFFFAOYSA-N
    • SMILES: ClC1=CC=C(C(=C1C)N)Cl

Computed Properties

  • Exact Mass: 174.99571
  • Monoisotopic Mass: 174.9955546g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 0
  • Complexity: 118
  • 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: 2.9
  • Topological Polar Surface Area: 26?2

Experimental Properties

  • Density: 1.334±0.06 g/cm3 (20 oC 760 Torr),
  • Boiling Point: 260.4±35.0 oC (760 Torr),
  • Flash Point: 111.3±25.9 oC,
  • Solubility: Very slightly soluble (0.13 g/l) (25 o C),
  • PSA: 26.02

3,6-dichloro-2-methylaniline Pricemore >>

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Additional information on 3,6-dichloro-2-methylaniline

Comprehensive Overview of Benzenamine, 3,6-dichloro-2-methyl- (CAS No. 62077-26-3)

Benzenamine, 3,6-dichloro-2-methyl- (CAS No. 62077-26-3) is a specialized organic compound that has garnered significant attention in the chemical and pharmaceutical industries. This compound, also known as 3,6-dichloro-2-methylaniline, belongs to the class of chlorinated aniline derivatives, which are widely used in the synthesis of various agrochemicals, dyes, and pharmaceutical intermediates. Its unique structural properties make it a valuable building block in organic synthesis, particularly in the development of crop protection agents and specialty chemicals.

The molecular formula of Benzenamine, 3,6-dichloro-2-methyl- is C7H7Cl2N, and it features a benzene ring substituted with two chlorine atoms at the 3 and 6 positions, a methyl group at the 2 position, and an amino group. This arrangement imparts distinct chemical reactivity, making it a versatile intermediate for further functionalization. Researchers and manufacturers often seek high-purity 3,6-dichloro-2-methylaniline for applications requiring precise control over molecular structure and reactivity.

One of the most prominent applications of Benzenamine, 3,6-dichloro-2-methyl- is in the agrochemical sector, where it serves as a key intermediate in the synthesis of herbicides and pesticides. With the growing global demand for sustainable agriculture and crop yield optimization, this compound has become increasingly relevant. Its role in the development of environmentally friendly agrochemicals aligns with current trends toward reducing the ecological footprint of farming practices. Additionally, its use in dye manufacturing highlights its versatility in industrial applications.

In the pharmaceutical industry, Benzenamine, 3,6-dichloro-2-methyl- is utilized as a precursor in the synthesis of active pharmaceutical ingredients (APIs). Its structural motifs are often incorporated into molecules designed for targeted drug delivery and therapeutic applications. The compound's ability to undergo various chemical transformations, such as amination and halogenation, makes it a valuable tool for medicinal chemists exploring new drug candidates. Recent studies have also investigated its potential in small-molecule drug discovery, particularly in addressing unmet medical needs.

The market dynamics for Benzenamine, 3,6-dichloro-2-methyl- reflect its importance in multiple industries. Suppliers and distributors often highlight its high purity grade and consistent quality as critical factors for buyers. With the rise of green chemistry initiatives, there is a growing emphasis on sustainable production methods for this compound, including catalytic processes and waste minimization techniques. Companies specializing in custom chemical synthesis frequently include this compound in their portfolios to meet the demands of research and industrial clients.

From a regulatory perspective, Benzenamine, 3,6-dichloro-2-methyl- is subject to standard chemical safety protocols to ensure safe handling and transportation. While it is not classified as a hazardous substance under most jurisdictions, proper laboratory safety measures are recommended when working with this compound. Material Safety Data Sheets (MSDS) provide detailed guidelines for its storage, handling, and disposal, ensuring compliance with occupational health and safety standards.

In conclusion, Benzenamine, 3,6-dichloro-2-methyl- (CAS No. 62077-26-3) is a multifaceted compound with significant applications in agrochemicals, pharmaceuticals, and specialty chemicals. Its role in sustainable agriculture and drug development underscores its relevance in modern science and industry. As research continues to explore new uses for this compound, its market presence is expected to grow, driven by innovations in green chemistry and precision synthesis. For researchers and manufacturers, understanding the properties and applications of this compound is essential for leveraging its full potential in their respective fields.

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