Cas no 1261904-79-3 (2-chloro-5-(2,3-difluorophenyl)benzoic Acid)

2-chloro-5-(2,3-difluorophenyl)benzoic Acid structure
1261904-79-3 structure
Product Name:2-chloro-5-(2,3-difluorophenyl)benzoic Acid
CAS No:1261904-79-3
MF:C13H7ClF2O2
MW:268.643289804459
MDL:MFCD18320022
CID:1223035
PubChem ID:53225936
Update Time:2025-07-17

2-chloro-5-(2,3-difluorophenyl)benzoic Acid Chemical and Physical Properties

Names and Identifiers

    • 2-chloro-5-(2,3-difluorophenyl)benzoic Acid
    • 1261904-79-3
    • MFCD18320022
    • DTXSID10689668
    • 2-Chloro-5-(2,3-difluorophenyl)benzoic acid, 95%
    • 4-Chloro-2',3'-difluoro[1,1'-biphenyl]-3-carboxylic acid
    • AKOS013306341
    • MDL: MFCD18320022
    • Inchi: 1S/C13H7ClF2O2/c14-10-5-4-7(6-9(10)13(17)18)8-2-1-3-11(15)12(8)16/h1-6H,(H,17,18)
    • InChI Key: SCPJHQPLMLCYOQ-UHFFFAOYSA-N
    • SMILES: ClC1C=CC(=CC=1C(=O)O)C1C=CC=C(C=1F)F

Computed Properties

  • Exact Mass: 268.0102635g/mol
  • Monoisotopic Mass: 268.0102635g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 2
  • Complexity: 313
  • 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: 3.9
  • Topological Polar Surface Area: 37.3?2

2-chloro-5-(2,3-difluorophenyl)benzoic Acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB327165-5 g
2-Chloro-5-(2,3-difluorophenyl)benzoic acid, 95%; .
1261904-79-3 95%
5g
€1159.00 2023-04-26
abcr
AB327165-5g
2-Chloro-5-(2,3-difluorophenyl)benzoic acid, 95%; .
1261904-79-3 95%
5g
€1159.00 2025-04-21

Additional information on 2-chloro-5-(2,3-difluorophenyl)benzoic Acid

Comprehensive Overview of 2-chloro-5-(2,3-difluorophenyl)benzoic Acid (CAS No. 1261904-79-3)

2-chloro-5-(2,3-difluorophenyl)benzoic Acid (CAS No. 1261904-79-3) is a specialized organic compound that has garnered significant attention in pharmaceutical and agrochemical research. This compound, characterized by its unique chloro and difluorophenyl substituents, serves as a critical intermediate in the synthesis of bioactive molecules. Its molecular structure, combining a benzoic acid backbone with halogenated aromatic rings, makes it a versatile building block for drug discovery and material science applications.

In recent years, the demand for fluorinated compounds like 2-chloro-5-(2,3-difluorophenyl)benzoic Acid has surged due to their enhanced metabolic stability and bioavailability. Researchers are particularly interested in its potential role in developing targeted therapies for inflammatory diseases and cancer. The compound's CAS No. 1261904-79-3 is frequently searched in academic databases, reflecting its relevance in cutting-edge research. Additionally, its synthetic pathways and purity optimization methods are hot topics in organic chemistry forums.

From an industrial perspective, 2-chloro-5-(2,3-difluorophenyl)benzoic Acid is valued for its scalability in production. Manufacturers emphasize green chemistry approaches to minimize environmental impact, aligning with global sustainability trends. Questions like "How to improve the yield of CAS 1261904-79-3?" or "What are the alternatives to toxic solvents in its synthesis?" dominate search engine queries, highlighting the need for eco-friendly innovations.

The compound's structure-activity relationship (SAR) is another focal point. Its chloro and difluorophenyl groups contribute to selective binding with biological targets, making it a candidate for precision medicine. Recent publications explore its derivatives as enzyme inhibitors, particularly in kinase and protease research. This aligns with the growing interest in personalized healthcare and AI-driven drug design, where computational models predict the efficacy of such compounds.

Analytical techniques like HPLC and NMR are essential for characterizing 2-chloro-5-(2,3-difluorophenyl)benzoic Acid. Purity standards (>98%) are rigorously maintained to meet regulatory requirements, especially in GMP-certified facilities. Searches for "HPLC methods for CAS 1261904-79-3" or "NMR spectra interpretation" reflect the technical challenges faced by quality control teams.

In summary, 2-chloro-5-(2,3-difluorophenyl)benzoic Acid (CAS No. 1261904-79-3) exemplifies the intersection of chemistry and innovation. Its applications span from drug development to sustainable manufacturing, addressing both scientific and environmental priorities. As research advances, this compound will likely play a pivotal role in next-generation therapeutics and materials.

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