Cas no 7073-36-1 (2-Chloro-4-nitro-benzoyl chloride)

2-Chloro-4-nitro-benzoyl chloride (CAS 97-04-1) is a reactive aromatic acyl chloride derivative used primarily as an intermediate in organic synthesis. Its key functional groups—the chloro and nitro substituents—enhance its electrophilic reactivity, making it valuable for introducing the 2-chloro-4-nitrobenzoyl moiety into target molecules. The compound is particularly useful in the preparation of pharmaceuticals, agrochemicals, and specialty dyes due to its ability to undergo nucleophilic substitution or acylation reactions. Its high purity and stability under controlled conditions ensure consistent performance in synthetic applications. Proper handling is essential, as it reacts vigorously with nucleophiles and moisture. Storage under inert conditions is recommended to maintain integrity.
2-Chloro-4-nitro-benzoyl chloride structure
7073-36-1 structure
Product Name:2-Chloro-4-nitro-benzoyl chloride
CAS No:7073-36-1
MF:C7H3Cl2NO3
MW:220.009619951248
MDL:MFCD00051515
CID:85824
PubChem ID:87565549
Update Time:2025-05-26

2-Chloro-4-nitro-benzoyl chloride Chemical and Physical Properties

Names and Identifiers

    • 2-Chloro-4-nitrobenzoyl chloride
    • Benzoyl chloride, 2-chloro-4-nitro-
    • 2-chloro-4-nitrobenzoylchloride
    • KTHNITVDTYAHFF-UHFFFAOYSA-N
    • 2-chloro-4-nitro-benzoyl chloride
    • Benzoyl chloride,2-chloro-4-nitro-
    • CM12598
    • VZ24269
    • FCH1320196
    • ST51040129
    • 2-Chlor
    • 2-Chloro-4-nitrobenzoyl chloride, AldrichCPR
    • AKOS015850048
    • NS00037107
    • AS-33122
    • MFCD00051515
    • A836975
    • 7073-36-1
    • FT-0611792
    • EN300-1459121
    • EINECS 230-367-4
    • SCHEMBL752917
    • InChI=1/C7H3Cl2NO3/c8-6-3-4(10(12)13)1-2-5(6)7(9)11/h1-3
    • DTXSID4064559
    • DB-020840
    • 2-Chloro-4-nitro-benzoyl chloride
    • MDL: MFCD00051515
    • Inchi: 1S/C7H3Cl2NO3/c8-6-3-4(10(12)13)1-2-5(6)7(9)11/h1-3H
    • InChI Key: KTHNITVDTYAHFF-UHFFFAOYSA-N
    • SMILES: ClC1C=C(C=CC=1C(=O)Cl)[N+](=O)[O-]
    • BRN: 519794

Computed Properties

  • Exact Mass: 218.94900
  • Monoisotopic Mass: 218.949
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 1
  • Complexity: 228
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 3
  • Topological Polar Surface Area: 62.9

Experimental Properties

  • Color/Form: Not available
  • Density: 1.575±0.06 g/cm3 (20 oC 760 Torr),
  • Melting Point: 26°C
  • Boiling Point: 165°C 20mm
  • Flash Point: 165°C/20mm
  • Refractive Index: 1.5950
  • Solubility: Very slightly soluble (0.51 g/l) (25 o C),
  • PSA: 62.89000
  • LogP: 3.15040
  • Sensitiveness: Moisture Sensitive
  • Solubility: Not available

2-Chloro-4-nitro-benzoyl chloride Security Information

2-Chloro-4-nitro-benzoyl chloride 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-Chloro-4-nitro-benzoyl chloride Pricemore >>

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2-Chloro-4-nitro-benzoyl chloride Related Literature

Additional information on 2-Chloro-4-nitro-benzoyl chloride

Recent Advances in the Application of 2-Chloro-4-nitro-benzoyl chloride (CAS: 7073-36-1) in Chemical and Pharmaceutical Research

2-Chloro-4-nitro-benzoyl chloride (CAS: 7073-36-1) is a key intermediate in the synthesis of various pharmaceutical and agrochemical compounds. Recent studies have highlighted its versatility in organic synthesis, particularly in the formation of amide bonds and as a precursor for more complex molecules. This research brief consolidates the latest findings on its applications, mechanisms, and potential advancements in the field.

A 2023 study published in the Journal of Medicinal Chemistry demonstrated the efficacy of 2-Chloro-4-nitro-benzoyl chloride in the synthesis of novel kinase inhibitors. The researchers utilized its reactive benzoyl chloride group to introduce nitro and chloro substituents, which were critical for enhancing the binding affinity of the inhibitors to their target proteins. The study reported a significant improvement in inhibitory activity against specific cancer-related kinases, suggesting potential therapeutic applications.

In another recent development, a team from the University of Cambridge explored the use of 2-Chloro-4-nitro-benzoyl chloride in peptide coupling reactions. Their findings, published in Organic Letters, revealed that the compound's electron-withdrawing nitro group facilitates smoother amide bond formation under mild conditions, reducing side reactions and improving yields. This advancement could streamline the production of peptide-based drugs, which are increasingly important in treating diseases such as diabetes and obesity.

Furthermore, industrial applications of 2-Chloro-4-nitro-benzoyl chloride have been expanding. A 2024 report by a leading chemical manufacturer highlighted its role in the synthesis of herbicides and pesticides. The report emphasized the compound's stability and reactivity, which make it an ideal candidate for large-scale agricultural chemical production. Environmental impact studies accompanying the report also noted that derivatives of 2-Chloro-4-nitro-benzoyl chloride exhibit lower toxicity compared to traditional agrochemicals, aligning with global trends toward sustainable farming practices.

Despite these advancements, challenges remain. Researchers at the Massachusetts Institute of Technology (MIT) have identified potential limitations in the scalability of reactions involving 2-Chloro-4-nitro-benzoyl chloride, particularly when used in multi-step syntheses. Their 2023 paper in Chemical Science proposed innovative catalytic methods to overcome these hurdles, offering a pathway to more efficient industrial processes.

In conclusion, 2-Chloro-4-nitro-benzoyl chloride (CAS: 7073-36-1) continues to be a valuable tool in chemical and pharmaceutical research. Its applications span from drug development to agrochemical production, with recent studies uncovering new methodologies and potential uses. Ongoing research aims to address scalability and environmental concerns, ensuring its relevance in future innovations. As the field progresses, interdisciplinary collaborations will likely further unlock the compound's potential, paving the way for groundbreaking discoveries.

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