Cas no 13300-62-4 (2,3-Dichloro-6-nitrobenzoic acid)

2,3-Dichloro-6-nitrobenzoic acid is a halogenated nitrobenzoic acid derivative with applications in organic synthesis and pharmaceutical intermediates. Its distinct structure, featuring both chloro and nitro substituents on the aromatic ring, enhances its reactivity in electrophilic and nucleophilic substitution reactions. The compound is valued for its role as a precursor in the synthesis of agrochemicals, dyes, and specialty chemicals. Its high purity and stability under controlled conditions make it suitable for precise laboratory use. The electron-withdrawing groups contribute to its utility in cross-coupling reactions and further functionalization. Proper handling is advised due to its potential irritant properties.
2,3-Dichloro-6-nitrobenzoic acid structure
13300-62-4 structure
Product Name:2,3-Dichloro-6-nitrobenzoic acid
CAS No:13300-62-4
MF:C7H3Cl2NO4
MW:236.009020090103
CID:119469
PubChem ID:22148809
Update Time:2025-11-02

2,3-Dichloro-6-nitrobenzoic acid Chemical and Physical Properties

Names and Identifiers

    • 2,3-Dichloro-6-nitrobenzoic acid
    • Benzoic acid,2,3-dichloro-6-nitro-
    • Benzoic acid,2,3-dichloro-6-nitro
    • RARECHEM AL BO 1420
    • Benzoic acid, 2,3-dichloro-6-nitro-
    • DTXSID30622956
    • EN300-8661258
    • AB23263
    • 13300-62-4
    • 2,3-Dichloro-6-nitrobenzoicacid
    • SCHEMBL2030471
    • AC-14750
    • AKOS015961758
    • G55305
    • MDL: MFCD06208396
    • Inchi: 1S/C7H3Cl2NO4/c8-3-1-2-4(10(13)14)5(6(3)9)7(11)12/h1-2H,(H,11,12)
    • InChI Key: MWFKWTVYKGMWEH-UHFFFAOYSA-N
    • SMILES: ClC1=C(C=CC(=C1C(=O)O)[N+](=O)[O-])Cl

Computed Properties

  • Exact Mass: 234.94400
  • Monoisotopic Mass: 234.944
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 255
  • 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: 2.2
  • Topological Polar Surface Area: 83.1A^2

Experimental Properties

  • Density: 1.713
  • Boiling Point: 369.1℃ at 760 mmHg
  • Flash Point: 177°C
  • Refractive Index: 1.638
  • PSA: 83.12000
  • LogP: 3.12300

2,3-Dichloro-6-nitrobenzoic acid Security Information

  • Hazard Category Code: 36/37/38
  • Safety Instruction: S26
  • Safety Term:S26-36/37/39
  • Risk Phrases:R36/37/38

2,3-Dichloro-6-nitrobenzoic acid Customs Data

  • HS CODE:2916399090
  • Customs Data:

    China Customs Code:

    2916399090

    Overview:

    2916399090 Other aromatic monocarboxylic acids. VAT:17.0% Tax refund rate:9.0% Regulatory conditions:nothing MFN tariff:6.5% general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to, Acrylic acid\Acrylates or esters shall be packaged clearly

    Summary:

    2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

2,3-Dichloro-6-nitrobenzoic acid Pricemore >>

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2,3-Dichloro-6-nitrobenzoic acid Related Literature

Additional information on 2,3-Dichloro-6-nitrobenzoic acid

Comprehensive Overview of 2,3-Dichloro-6-nitrobenzoic Acid (CAS No. 13300-62-4): Properties, Applications, and Industry Insights

2,3-Dichloro-6-nitrobenzoic acid (CAS No. 13300-62-4) is a specialized organic compound widely recognized for its unique chemical structure and versatile applications in research and industrial processes. This nitrobenzoic acid derivative features a benzene ring substituted with two chlorine atoms and a nitro group, making it a valuable intermediate in synthetic chemistry. Its molecular formula, C7H3Cl2NO4, highlights its role as a building block for more complex molecules.

In recent years, the demand for halogenated aromatic compounds like 2,3-dichloro-6-nitrobenzoic acid has surged due to their utility in pharmaceuticals, agrochemicals, and material science. Researchers frequently search for "synthesis methods for nitrobenzoic acids" or "applications of dichloronitrobenzoic acid," reflecting growing interest in sustainable synthesis routes and green chemistry adaptations. The compound’s thermal stability and reactivity with nucleophiles make it a candidate for catalytic transformations, aligning with trends in atom-efficient reactions.

The physicochemical properties of CAS 13300-62-4 include a melting point range of 160–165°C and moderate solubility in polar organic solvents such as dimethyl sulfoxide (DMSO) and methanol. These traits are critical for its use in fine chemical manufacturing, where purity and reproducibility are paramount. Analytical techniques like HPLC and NMR are commonly employed to characterize this compound, addressing frequent queries such as "how to analyze 2,3-dichloro-6-nitrobenzoic acid purity."

From an industrial perspective, 2,3-dichloro-6-nitrobenzoic acid serves as a precursor in dye synthesis and polymer modification. Its electron-withdrawing groups enhance reactivity in electrophilic aromatic substitution, a topic often explored in "advanced organic chemistry tutorials." Innovations in catalysis and flow chemistry have further expanded its utility, reducing waste generation—a key concern for environmentally conscious manufacturers.

Safety and handling of nitroaromatic compounds remain a focal point for laboratories. While 13300-62-4 is not classified as hazardous under standard protocols, proper storage in cool, dry conditions is recommended to maintain stability. This aligns with search trends like "best practices for handling nitrobenzoic acids" and "storage conditions for halogenated aromatics," emphasizing user interest in operational safety.

In conclusion, 2,3-dichloro-6-nitrobenzoic acid exemplifies the intersection of traditional chemistry and modern innovation. Its role in high-value chemical synthesis and compatibility with emerging technologies ensures sustained relevance. Future research may explore its potential in bioconjugation or metal-organic frameworks, addressing queries like "new applications for dichloronitrobenzoic acid derivatives." As industries prioritize sustainability, this compound’s adaptability positions it as a key player in next-generation chemical solutions.

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