Cas no 318469-40-8 ({1-Methyl-3-(trifluoromethyl)-5-3-(trifluoro-methyl)phenoxy-1H-pyrazol-4-yl}methanol)

Technical Introduction: {1-Methyl-3-(trifluoromethyl)-5-[3-(trifluoromethyl)phenoxy]-1H-pyrazol-4-yl}methanol is a fluorinated pyrazole derivative characterized by its trifluoromethyl and phenoxy substituents, which enhance its stability and reactivity in synthetic applications. The presence of multiple fluorine atoms contributes to increased lipophilicity and metabolic resistance, making it valuable in pharmaceutical and agrochemical research. The hydroxymethyl group at the 4-position offers a versatile handle for further functionalization, enabling its use as a key intermediate in the synthesis of biologically active compounds. Its structural features suggest potential utility in the development of enzyme inhibitors or receptor modulators, particularly where electron-withdrawing properties are advantageous. The compound’s well-defined stereochemistry and purity ensure reproducibility in research settings.
{1-Methyl-3-(trifluoromethyl)-5-3-(trifluoro-methyl)phenoxy-1H-pyrazol-4-yl}methanol structure
318469-40-8 structure
Product Name:{1-Methyl-3-(trifluoromethyl)-5-3-(trifluoro-methyl)phenoxy-1H-pyrazol-4-yl}methanol
CAS No:318469-40-8
MF:C13H10F6N2O2
MW:340.221124172211
MDL:MFCD00172663
CID:1077672
PubChem ID:2775698
Update Time:2025-06-07

{1-Methyl-3-(trifluoromethyl)-5-3-(trifluoro-methyl)phenoxy-1H-pyrazol-4-yl}methanol Chemical and Physical Properties

Names and Identifiers

    • 1-(tert-Butyl)-3-((3-(tert-butyl)-2-ethyl-5-methylcyclopenta-1,3-dien-1-yl)methyl)benzene
    • {1-Methyl-3-(trifluoromethyl)-5-[3-(trifluoro-methyl)phenoxy]-1H-pyrazol-4-yl}methanol
    • [1-Methyl-3-(trifluoromethyl)-5-[3-(trifluoromethyl)phenoxy]-1H-pyrazol-4-yl]methanol
    • {1-METHYL-3-(TRIFLUOROMETHYL)-5-[3-(TRIFLUOROMETHYL)PHENOXY]-1H-PYRAZOL-4-YL}METHANOL
    • 5G-355S
    • AC1MCQEV
    • CTK8A2369
    • MolPort-001-778-350
    • AKOS005070544
    • 318469-40-8
    • DTXSID00379662
    • (1-Methyl-3-(trifluoromethyl)-5-(3-(trifluoromethyl)phenoxy)-1H-pyrazol-4-yl)methanol
    • [1-methyl-3-(trifluoromethyl)-5-[3-(trifluoromethyl)phenoxy]pyrazol-4-yl]methanol
    • MFCD00172663
    • (1-Methyl-3-(trifluoromethyl)-5-[3-(trifluoromethyl)phenoxy]-1h-pyrazol-4-yl)methanol
    • J-500234
    • CS-0333067
    • {1-Methyl-3-(trifluoromethyl)-5-3-(trifluoro-methyl)phenoxy-1H-pyrazol-4-yl}methanol
    • MDL： MFCD00172663
    • Inchi： 1S/C13H10F6N2O2/c1-21-11(9(6-22)10(20-21)13(17,18)19)23-8-4-2-3-7(5-8)12(14,15)16/h2-5,22H,6H2,1H3
    • InChI Key： BJRDDNWYIXOJIN-UHFFFAOYSA-N
    • SMILES： FC(C1C(CO)=C(N(C)N=1)OC1C=CC=C(C(F)(F)F)C=1)(F)F

Computed Properties

  • Exact Mass: 340.06464654g/mol
  • Monoisotopic Mass: 340.06464654g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 5
  • Complexity: 403
  • 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
  • Topological Polar Surface Area: 47.3?2

Experimental Properties

  • Melting Point: 81-83°C

{1-Methyl-3-(trifluoromethyl)-5-3-(trifluoro-methyl)phenoxy-1H-pyrazol-4-yl}methanol Security Information

  • Hazard Statement： Irritant
  • Hazardous Material Identification： Xi
  • HazardClass：IRRITANT

{1-Methyl-3-(trifluoromethyl)-5-3-(trifluoro-methyl)phenoxy-1H-pyrazol-4-yl}methanol Pricemore >>

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{1-Methyl-3-(trifluoromethyl)-5-3-(trifluoro-methyl)phenoxy-1H-pyrazol-4-yl}methanol Suppliers

Amadis Chemical Company Limited
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(CAS:318469-40-8){1-Methyl-3-(trifluoromethyl)-5-3-(trifluoro-methyl)phenoxy-1H-pyrazol-4-yl}methanol
Order Number:A1153065
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Thursday, 29 August 2024 23:20
Price ($):380.0

{1-Methyl-3-(trifluoromethyl)-5-3-(trifluoro-methyl)phenoxy-1H-pyrazol-4-yl}methanol Related Literature

318469-40-8 ({1-Methyl-3-(trifluoromethyl)-5-3-(trifluoro-methyl)phenoxy-1H-pyrazol-4-yl}methanol) Related Products

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Amadis Chemical Company Limited
(CAS:318469-40-8){1-Methyl-3-(trifluoromethyl)-5-3-(trifluoro-methyl)phenoxy-1H-pyrazol-4-yl}methanol
A1153065
Purity:99%
Quantity:1g
Price ($):380.0
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