Cas no 1261934-25-1 (2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid)

2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid is a halogenated nicotinic acid derivative with a biphenyl structure, offering versatility as an intermediate in organic synthesis. Its key advantages include its role in pharmaceutical and agrochemical research, particularly in the development of active compounds due to its reactive chloro and carboxylic acid functional groups. The compound's structural features enable selective modifications, facilitating the synthesis of heterocyclic and aromatic derivatives. Its stability under standard conditions ensures reliable handling and storage. The presence of both chloro and methyl substituents enhances its utility in cross-coupling reactions, making it valuable for constructing complex molecular frameworks in medicinal chemistry and material science applications.
2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid structure
1261934-25-1 structure
Product Name:2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid
CAS No:1261934-25-1
MF:C13H9Cl2NO2
MW:282.122061491013
MDL:MFCD18317602
CID:2764470
PubChem ID:53223471
Update Time:2025-05-26

2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid Chemical and Physical Properties

Names and Identifiers

    • 2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid, 95%
    • MFCD18317602
    • 1261934-25-1
    • DTXSID30687626
    • 2-CHLORO-5-(3-CHLORO-4-METHYLPHENYL)NICOTINIC ACID
    • 2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid
    • MDL: MFCD18317602
    • Inchi: 1S/C13H9Cl2NO2/c1-7-2-3-8(5-11(7)14)9-4-10(13(17)18)12(15)16-6-9/h2-6H,1H3,(H,17,18)
    • InChI Key: OUQMIZQQFWEHME-UHFFFAOYSA-N
    • SMILES: ClC1C=C(C=CC=1C)C1C=NC(=C(C(=O)O)C=1)Cl

Computed Properties

  • Exact Mass: 281.0010339Da
  • Monoisotopic Mass: 281.0010339Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • 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: 4
  • Topological Polar Surface Area: 50.2?2

2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB324269-5 g
2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid, 95%; .
1261934-25-1 95%
5g
€1,159.00 2022-08-31
abcr
AB324269-5g
2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid, 95%; .
1261934-25-1 95%
5g
€1159.00 2025-04-21

Additional information on 2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid

Comprehensive Overview of 2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid (CAS No. 1261934-25-1)

2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid (CAS No. 1261934-25-1) is a specialized organic compound that has garnered significant attention in pharmaceutical and agrochemical research. This nicotinic acid derivative is characterized by its unique molecular structure, which includes a chloro-substituted phenyl ring and a nicotinic acid backbone. Its chemical properties make it a valuable intermediate in the synthesis of more complex molecules, particularly in the development of novel therapeutic agents and crop protection chemicals.

The compound's CAS number 1261934-25-1 serves as a unique identifier, ensuring precise tracking in regulatory and research contexts. Researchers and industry professionals often search for 2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid suppliers or CAS 1261934-25-1 synthesis methods, reflecting its growing demand in specialized applications. Its structural features, such as the chloro and methyl substituents, contribute to its reactivity and potential bioactivity, making it a subject of ongoing studies in medicinal chemistry.

In recent years, the interest in nicotinic acid derivatives has surged due to their potential applications in drug discovery. For instance, compounds like 2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid are explored for their role in modulating enzymatic pathways or as building blocks for small-molecule inhibitors. This aligns with the broader trend of targeting specific molecular interactions in disease treatment, a hot topic in pharmaceutical research.

From an agrochemical perspective, the compound's chlorinated aromatic system may offer herbicidal or fungicidal properties, addressing the need for sustainable crop protection solutions. Searches for chloro-substituted phenyl compounds in agriculture or nicotinic acid-based agrochemicals highlight this relevance. Its potential to act as a precursor for environmentally friendly pesticides aligns with the global push toward greener farming practices.

The synthesis of CAS 1261934-25-1 typically involves multi-step organic reactions, including halogenation and cross-coupling techniques. Researchers often look for optimized synthesis routes for 2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid to improve yield and purity, reflecting the compound's technical challenges. Advances in catalytic methods or green chemistry approaches could further enhance its production efficiency.

Analytical characterization of 2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid relies on techniques like HPLC, NMR, and mass spectrometry, ensuring quality control in industrial and academic settings. Questions such as how to analyze CAS 1261934-25-1 purity or spectroscopic data for nicotinic acid derivatives are common among chemists, underscoring the need for reliable analytical protocols.

In summary, 2-Chloro-5-(3-chloro-4-methylphenyl)nicotinic acid (CAS No. 1261934-25-1) represents a versatile compound with promising applications in pharmaceuticals and agrochemicals. Its structural complexity and functional groups make it a focal point for innovation, driven by the demand for targeted therapies and sustainable agricultural solutions. As research progresses, this compound is likely to remain a key player in the development of next-generation bioactive molecules.

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