Cas no 1111129-29-3 (5-(2-fluoro-4-methylphenyl)-2-hydroxybenzaldehyde)

5-(2-Fluoro-4-methylphenyl)-2-hydroxybenzaldehyde is a fluorinated aromatic aldehyde featuring a hydroxyl group at the ortho position relative to the formyl functionality. This compound is of interest in organic synthesis due to its bifunctional reactivity, enabling its use as a versatile intermediate in the preparation of pharmaceuticals, agrochemicals, and specialty chemicals. The presence of both the electron-withdrawing fluoro substituent and the electron-donating hydroxyl group enhances its utility in regioselective reactions, such as condensations or metal-catalyzed cross-couplings. Its structural motifs make it valuable for constructing complex heterocyclic frameworks or as a precursor for ligands in coordination chemistry. The compound exhibits moderate stability under standard conditions, facilitating handling and storage.
5-(2-fluoro-4-methylphenyl)-2-hydroxybenzaldehyde structure
1111129-29-3 structure
Product Name:5-(2-fluoro-4-methylphenyl)-2-hydroxybenzaldehyde
CAS No:1111129-29-3
MF:C14H11FO2
MW:230.234347581863
MDL:MFCD11877752
CID:1195730
PubChem ID:53220336
Update Time:2025-06-14

5-(2-fluoro-4-methylphenyl)-2-hydroxybenzaldehyde Chemical and Physical Properties

Names and Identifiers

    • 5-(2-fluoro-4-methylphenyl)-2-hydroxybenzaldehyde
    • 1111129-29-3
    • 4-(2-Fluoro-4-methylphenyl)-2-formylphenol, 95%
    • 2'-Fluoro-4-hydroxy-4'-methyl[1,1'-biphenyl]-3-carbaldehyde
    • DTXSID50685083
    • 4-(2-FLUORO-4-METHYLPHENYL)-2-FORMYLPHENOL
    • MFCD11877752
    • MDL： MFCD11877752
    • Inchi： 1S/C14H11FO2/c1-9-2-4-12(13(15)6-9)10-3-5-14(17)11(7-10)8-16/h2-8,17H,1H3
    • InChI Key： QDQORVOTZUCQMG-UHFFFAOYSA-N
    • SMILES： FC1C=C(C)C=CC=1C1C=CC(=C(C=O)C=1)O

Computed Properties

  • Exact Mass: 230.07430775g/mol
  • Monoisotopic Mass: 230.07430775g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 2
  • Complexity: 269
  • 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: 3.7
  • Topological Polar Surface Area: 37.3?2

5-(2-fluoro-4-methylphenyl)-2-hydroxybenzaldehyde Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
abcr
AB320731-5 g
4-(2-Fluoro-4-methylphenyl)-2-formylphenol, 95%; .
 1111129-29-3 95%
5g
 €1159.00 2023-04-26
abcr
AB320731-5g
4-(2-Fluoro-4-methylphenyl)-2-formylphenol, 95%; .
 1111129-29-3 95%
5g
 €1159.00 2025-02-21

5-(2-fluoro-4-methylphenyl)-2-hydroxybenzaldehyde Related Literature

Additional information on 5-(2-fluoro-4-methylphenyl)-2-hydroxybenzaldehyde

Comprehensive Analysis of 5-(2-fluoro-4-methylphenyl)-2-hydroxybenzaldehyde (CAS No. 1111129-29-3): Properties, Applications, and Industry Insights

The compound 5-(2-fluoro-4-methylphenyl)-2-hydroxybenzaldehyde (CAS No. 1111129-29-3) is a fluorinated aromatic aldehyde with a unique molecular structure, combining a hydroxybenzaldehyde core with a 2-fluoro-4-methylphenyl substituent. This structural configuration endows the molecule with distinct physicochemical properties, making it a subject of interest in pharmaceutical research, material science, and specialty chemical synthesis. Its fluoro and hydroxy functional groups contribute to its reactivity, enabling applications in cross-coupling reactions and as a precursor for bioactive molecules.

In recent years, the demand for fluorinated organic compounds like 5-(2-fluoro-4-methylphenyl)-2-hydroxybenzaldehyde has surged due to their role in drug discovery. Fluorination is a key strategy in medicinal chemistry to enhance metabolic stability, bioavailability, and binding affinity. Researchers frequently search for "fluorinated benzaldehyde derivatives" or "CAS 1111129-29-3 applications" to explore its potential in designing kinase inhibitors or antimicrobial agents. The compound’s methylphenyl moiety further augments its lipophilicity, a critical factor in CNS drug development.

From a synthetic perspective, 5-(2-fluoro-4-methylphenyl)-2-hydroxybenzaldehyde is synthesized via palladium-catalyzed cross-coupling or formylation reactions. Its aldehyde group serves as a versatile handle for condensation reactions, enabling the construction of heterocycles such as quinazolines or imidazoles. Industry professionals often inquire about "synthesis of hydroxybenzaldehyde derivatives" or "CAS 1111129-29-3 suppliers," reflecting its commercial relevance. Analytical techniques like HPLC and NMR confirm its high purity (>98%), a requirement for regulatory-compliant research.

Environmental and safety profiles of CAS 1111129-29-3 align with green chemistry trends. Unlike traditional halogenated compounds, its fluoro substitution minimizes ecological persistence. Searches for "sustainable fluorinated intermediates" highlight this shift. Additionally, the compound’s solid-state stability under ambient conditions makes it suitable for scalable manufacturing, addressing queries about "storage of aromatic aldehydes."

In material science, 5-(2-fluoro-4-methylphenyl)-2-hydroxybenzaldehyde is investigated for liquid crystal and polymer applications. Its planar structure and dipole moment facilitate π-π stacking, a feature exploited in OLEDs. Terms like "fluorinated aldehydes in electronics" or "CAS 1111129-29-3 patents" frequently appear in technical literature, underscoring its multidisciplinary utility.

To conclude, 5-(2-fluoro-4-methylphenyl)-2-hydroxybenzaldehyde exemplifies the convergence of synthetic versatility and functional efficacy. Its CAS No. 1111129-29-3 is a beacon for researchers navigating fluorochemistry’s expanding frontiers, from life sciences to advanced materials. As innovation accelerates, this compound will remain pivotal in addressing global challenges like drug resistance and energy-efficient technologies.

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