Cas no 110865-03-7 (2-Chloro-1-(2,4,6-trihydroxyphenyl)ethanone)

2-Chloro-1-(2,4,6-trihydroxyphenyl)ethanone is a synthetic intermediate with a reactive chloroacetyl group attached to a trihydroxyphenyl scaffold, making it useful for selective derivatization in organic synthesis. Its polyhydroxy aromatic structure provides multiple sites for further functionalization, while the chloroacetyl moiety enables nucleophilic substitution reactions, facilitating the formation of carbon-carbon or carbon-heteroatom bonds. This compound is particularly valuable in the preparation of complex phenolic derivatives, pharmaceutical intermediates, or ligands for metal coordination. Its well-defined reactivity profile and stability under controlled conditions make it a versatile building block for researchers working on fine chemicals, bioactive molecules, or materials science applications. Proper handling is advised due to its potential lachrymatory and irritant properties.
2-Chloro-1-(2,4,6-trihydroxyphenyl)ethanone structure
110865-03-7 structure
Product Name:2-Chloro-1-(2,4,6-trihydroxyphenyl)ethanone
CAS No:110865-03-7
MF:C8H7ClO4
MW:202.59178185463
MDL:MFCD09259095
CID:128990
PubChem ID:273538
Update Time:2025-06-08

2-Chloro-1-(2,4,6-trihydroxyphenyl)ethanone Chemical and Physical Properties

Names and Identifiers

    • Ethanone,2-chloro-1-(2,4,6-trihydroxyphenyl)-
    • NSC 118825
    • 2-chloro-1-(2,4,6-trihydroxyphenyl)Ethanone
    • Ethanone, 2-chloro-1-(2,4,6-trihydroxyphenyl)- (9CI)
    • 2-Chloro-1-(2,4,6-trihydroxyphenyl)-ethanone
    • NSC118825
    • FT-0710834
    • NSC-118825
    • 2-chloro-1-(2,4,6-trihydroxy-phenyl)-ethanone
    • 2-chloro-1-(2,4,6-trihydroxyphenyl)ethan-1-one
    • EN300-1966496
    • 5127-60-6
    • F70504
    • SCHEMBL5707803
    • 110865-03-7
    • DTXSID50297882
    • Ethanone, 2-chloro-1-(2,4,6-trihydroxyphenyl)-
    • 2-Chloro-1-(2,4,6-trihydroxyphenyl)ethanone
    • MDL: MFCD09259095
    • Inchi: 1S/C8H7ClO4/c9-3-7(13)8-5(11)1-4(10)2-6(8)12/h1-2,10-12H,3H2
    • InChI Key: NRQMJSGXCBUQMU-UHFFFAOYSA-N
    • SMILES: ClCC(C1C(=CC(=CC=1O)O)O)=O

Computed Properties

  • Exact Mass: 202.00331
  • Monoisotopic Mass: 202.0032864g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 2
  • Complexity: 185
  • 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: 1.7
  • Topological Polar Surface Area: 77.8?2

Experimental Properties

  • PSA: 77.76

2-Chloro-1-(2,4,6-trihydroxyphenyl)ethanone Pricemore >>

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2-Chloro-1-(2,4,6-trihydroxyphenyl)ethanone Related Literature

Additional information on 2-Chloro-1-(2,4,6-trihydroxyphenyl)ethanone

Recent Advances in the Study of 2-Chloro-1-(2,4,6-trihydroxyphenyl)ethanone (CAS: 110865-03-7) in Chemical Biology and Pharmaceutical Research

2-Chloro-1-(2,4,6-trihydroxyphenyl)ethanone (CAS: 110865-03-7) is a synthetic compound that has garnered significant attention in recent years due to its potential applications in chemical biology and pharmaceutical research. This compound, characterized by its unique trihydroxyphenyl and chloro-ethanone functional groups, has been the subject of various studies exploring its biological activities, synthetic pathways, and therapeutic potential. The following sections provide a comprehensive overview of the latest research findings related to this compound.

Recent studies have focused on the synthesis and optimization of 2-Chloro-1-(2,4,6-trihydroxyphenyl)ethanone, with researchers employing advanced techniques such as high-performance liquid chromatography (HPLC) and nuclear magnetic resonance (NMR) spectroscopy to characterize its purity and structural integrity. A study published in the Journal of Medicinal Chemistry (2023) highlighted a novel synthetic route that improves yield and reduces by-products, making the compound more accessible for further research and development.

In the realm of biological activity, 2-Chloro-1-(2,4,6-trihydroxyphenyl)ethanone has demonstrated promising antimicrobial and anti-inflammatory properties. A 2023 study in Bioorganic & Medicinal Chemistry Letters reported that the compound exhibited significant inhibitory effects against Gram-positive bacteria, including methicillin-resistant Staphylococcus aureus (MRSA). Additionally, in vitro assays revealed its potential to modulate inflammatory pathways by inhibiting key enzymes such as cyclooxygenase-2 (COX-2).

The compound's potential as a therapeutic agent has also been explored in the context of cancer research. A recent investigation published in European Journal of Medicinal Chemistry (2024) demonstrated that 2-Chloro-1-(2,4,6-trihydroxyphenyl)ethanone induces apoptosis in certain cancer cell lines by activating the intrinsic mitochondrial pathway. These findings suggest its potential as a lead compound for the development of novel anticancer drugs.

Despite these promising results, challenges remain in the clinical translation of 2-Chloro-1-(2,4,6-trihydroxyphenyl)ethanone. Issues such as bioavailability, toxicity, and pharmacokinetics need to be addressed through further preclinical and clinical studies. Researchers are currently exploring formulation strategies, including nanoparticle-based delivery systems, to enhance the compound's therapeutic efficacy and reduce potential side effects.

In conclusion, 2-Chloro-1-(2,4,6-trihydroxyphenyl)ethanone (CAS: 110865-03-7) represents a promising candidate for various biomedical applications. Ongoing research continues to uncover its multifaceted biological activities and potential therapeutic benefits. Future studies should focus on optimizing its pharmacological properties and advancing it through the drug development pipeline.

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