Cas no 15125-93-6 (Hexyl 2-hydroxy-5-iodobenzoate)

Hexyl 2-hydroxy-5-iodobenzoate is a halogenated aromatic ester with applications in organic synthesis and pharmaceutical research. Its structure combines a hexyl ester group with a hydroxyl and iodine substituent on the benzoate ring, offering reactivity for further functionalization. The iodine moiety provides a handle for cross-coupling reactions, such as Suzuki or Sonogashira couplings, while the hydroxyl group allows for additional derivatization. This compound is particularly useful in the development of bioactive molecules or as an intermediate in material science. Its stability and solubility in organic solvents make it a practical choice for laboratory-scale reactions requiring controlled iodine incorporation.
Hexyl 2-hydroxy-5-iodobenzoate structure
15125-93-6 structure
Product Name:Hexyl 2-hydroxy-5-iodobenzoate
CAS No:15125-93-6
MF:C13H17IO3
MW:348.176756620407
CID:1030728
PubChem ID:44829104
Update Time:2025-05-20

Hexyl 2-hydroxy-5-iodobenzoate Chemical and Physical Properties

Names and Identifiers

    • Hexyl 2-hydroxy-5-iodobenzoate
    • LogP
    • AKOS015843138
    • 15125-93-6
    • A809148
    • DTXSID70661187
    • DB-063892
    • Hexyl2-hydroxy-5-iodobenzoate
    • Inchi: 1S/C13H17IO3/c1-2-3-4-5-8-17-13(16)11-9-10(14)6-7-12(11)15/h6-7,9,15H,2-5,8H2,1H3
    • InChI Key: IRVINRLXYQRBMV-UHFFFAOYSA-N
    • SMILES: IC1C=CC(=C(C=1)C(=O)OCCCCCC)O

Computed Properties

  • Exact Mass: 348.02181
  • Monoisotopic Mass: 348.02224g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 7
  • Complexity: 233
  • 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: 6.4
  • Topological Polar Surface Area: 46.5?2

Experimental Properties

  • PSA: 46.53

Hexyl 2-hydroxy-5-iodobenzoate Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
Alichem
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Chemenu
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Ambeed
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Additional information on Hexyl 2-hydroxy-5-iodobenzoate

Comprehensive Overview of Hexyl 2-hydroxy-5-iodobenzoate (CAS No. 15125-93-6): Properties, Applications, and Innovations

Hexyl 2-hydroxy-5-iodobenzoate (CAS No. 15125-93-6) is a specialized organic compound that has garnered significant attention in the fields of pharmaceuticals, agrochemicals, and material science. This ester derivative of 5-iodosalicylic acid combines a hexyl group with a hydroxyl and iodine-substituted benzoate moiety, resulting in unique chemical properties. Researchers and industry professionals frequently search for terms like "Hexyl 2-hydroxy-5-iodobenzoate synthesis," "CAS 15125-93-6 applications," and "iodobenzoate derivatives" to explore its potential. Its molecular structure, characterized by the iodo-aromatic ring, offers versatility in synthetic pathways and functional modifications.

The compound’s physicochemical properties, such as solubility in organic solvents and thermal stability, make it a valuable intermediate in fine chemical synthesis. Recent studies highlight its role in developing UV-absorbing materials and bioactive molecules, aligning with trends in sustainable chemistry and green synthesis. Users often inquire about "eco-friendly production methods for iodobenzoates" or "Hexyl 2-hydroxy-5-iodobenzoate safety data," reflecting growing environmental and safety concerns. Analytical techniques like HPLC and NMR are critical for quality control, ensuring compliance with industry standards.

In pharmaceuticals, Hexyl 2-hydroxy-5-iodobenzoate serves as a precursor for anti-inflammatory agents and antimicrobial compounds. Its iodine moiety enhances binding affinity in drug-receptor interactions, a topic frequently searched as "iodinated drug design." Meanwhile, agrochemical applications leverage its pesticidal properties, with queries like "iodobenzoate-based pesticides" gaining traction. Innovations in nanotechnology further explore its use in functional coatings and sensors, addressing demands for smart materials.

Market trends indicate rising interest in high-purity Hexyl 2-hydroxy-5-iodobenzoate, driven by R&D investments. Regulatory frameworks, such as REACH and FDA guidelines, ensure safe handling and commercialization. FAQs like "where to buy CAS 15125-93-6" or "technical specifications of iodobenzoate esters" underscore its commercial relevance. Future research may focus on catalytic synthesis and biodegradability, aligning with circular economy principles.

In summary, Hexyl 2-hydroxy-5-iodobenzoate (CAS No. 15125-93-6) exemplifies the intersection of innovation and utility. Its multifaceted applications, from life sciences to advanced materials, position it as a compound of enduring scientific and industrial value. By addressing user queries and industry trends, this overview bridges knowledge gaps while emphasizing safety, sustainability, and cutting-edge developments.

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