Cas no 2091185-13-4 ((1-(Prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol)

(1-(Prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol is a versatile pyrazole-based intermediate with a trifluoromethyl group and a propargyl substituent, offering distinct reactivity for synthetic applications. The presence of the trifluoromethyl group enhances electrophilic properties and metabolic stability, making it valuable in pharmaceutical and agrochemical research. The propargyl moiety allows for further functionalization via click chemistry or cross-coupling reactions, while the hydroxymethyl group provides a handle for derivatization. This compound is particularly useful in the development of bioactive molecules, where its structural features contribute to improved binding affinity and selectivity. Its well-defined synthetic route ensures consistent purity, supporting reliable performance in complex organic transformations.
(1-(Prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol structure
2091185-13-4 structure
Product Name:(1-(Prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol
CAS No:2091185-13-4
MF:C8H7F3N2O
MW:204.149192094803
CID:5044351
Update Time:2025-05-20

(1-(Prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol Chemical and Physical Properties

Names and Identifiers

    • (1-(prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol
    • [2-prop-2-ynyl-5-(trifluoromethyl)pyrazol-3-yl]methanol
    • (1-(Prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol
    • Inchi： 1S/C8H7F3N2O/c1-2-3-13-6(5-14)4-7(12-13)8(9,10)11/h1,4,14H,3,5H2
    • InChI Key： PYGMXCXURRXOHI-UHFFFAOYSA-N
    • SMILES： FC(C1C=C(CO)N(CC#C)N=1)(F)F

Computed Properties

  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 245
  • XLogP3: 0.5
  • Topological Polar Surface Area: 38

(1-(Prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol Pricemore >>

Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
TRC
P139446-1g
(1-(prop-2-yn-1-yl)-3-(trifluoromethyl)-1h-pyrazol-5-yl)methanol
 2091185-13-4
1g
 $ 475.00 2022-06-03
TRC
P139446-100mg
(1-(prop-2-yn-1-yl)-3-(trifluoromethyl)-1h-pyrazol-5-yl)methanol
 2091185-13-4
100mg
 $ 95.00 2022-06-03
TRC
P139446-500mg
(1-(prop-2-yn-1-yl)-3-(trifluoromethyl)-1h-pyrazol-5-yl)methanol
 2091185-13-4
500mg
 $ 320.00 2022-06-03
Life Chemicals
F2198-0123-0.25g
(1-(prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol
 2091185-13-4 95%+
0.25g
 $302.0 2023-09-06
Life Chemicals
F2198-0123-0.5g
(1-(prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol
 2091185-13-4 95%+
0.5g
 $318.0 2023-09-06
Life Chemicals
F2198-0123-1g
(1-(prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol
 2091185-13-4 95%+
1g
 $335.0 2023-09-06
Life Chemicals
F2198-0123-2.5g
(1-(prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol
 2091185-13-4 95%+
2.5g
 $670.0 2023-09-06
Life Chemicals
F2198-0123-5g
(1-(prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol
 2091185-13-4 95%+
5g
 $1005.0 2023-09-06
Life Chemicals
F2198-0123-10g
(1-(prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol
 2091185-13-4 95%+
10g
 $1407.0 2023-09-06

(1-(Prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol Related Literature

Additional information on (1-(Prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol

Comprehensive Overview of (1-(Prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol (CAS No. 2091185-13-4)

(1-(Prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol is a specialized organic compound with significant potential in pharmaceutical and agrochemical research. Its unique structure, featuring a propargyl group and a trifluoromethyl substituent, makes it a valuable intermediate for synthesizing bioactive molecules. The compound's CAS No. 2091185-13-4 ensures precise identification in scientific databases, aligning with the growing demand for high-purity chemical intermediates in drug discovery.

Recent trends in AI-driven drug design and green chemistry have heightened interest in compounds like (1-(Prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol. Researchers frequently search for "pyrazole derivatives in medicinal chemistry" or "trifluoromethyl group applications," reflecting its relevance in developing targeted therapies and sustainable synthesis routes. The compound's methanol-functionalized pyrazole core offers versatility for further modifications, addressing challenges in bioavailability optimization and selective binding.

From a synthetic perspective, the propargyl moiety in this compound enables click chemistry applications, a hotspot in bioconjugation and material science. Laboratories focusing on high-throughput screening often prioritize such building blocks to accelerate lead compound identification. Analytical data for CAS 2091185-13-4 typically includes HPLC purity >98%, meeting stringent requirements for preclinical studies.

Environmental and regulatory considerations are critical for (1-(Prop-2-yn-1-yl)-3-(trifluoromethyl)-1H-pyrazol-5-yl)methanol. Its fluorinated structure aligns with the pharmaceutical industry's shift toward metabolically stable compounds, while its synthesis adheres to REACH compliance standards. FAQs like "pyrazole methanol solubility" or "stability of trifluoromethylpyrazoles" underscore its practical handling parameters.

In conclusion, CAS No. 2091185-13-4 represents a cutting-edge tool for innovators exploring heterocyclic chemistry and small-molecule therapeutics. Its dual functionality—combining a reactive alkyne group with a polar hydroxymethyl unit—positions it as a keystone in modern structure-activity relationship (SAR) studies, answering the demand for multifunctional scaffolds in life sciences.

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