Cas no 1217501-32-0 ((4-(Benzyloxy)-2-(trifluoromethyl)phenyl)boronic acid)

(4-(Benzyloxy)-2-(trifluoromethyl)phenyl)boronic acid is a boronic acid derivative featuring a benzyloxy substituent and a trifluoromethyl group on the phenyl ring. This compound serves as a valuable intermediate in Suzuki-Miyaura cross-coupling reactions, enabling the synthesis of biaryl structures with enhanced electronic properties due to the electron-withdrawing CF? group. The benzyloxy moiety provides additional functionalization potential, making it useful in pharmaceutical and materials science applications. Its stability under typical coupling conditions and compatibility with diverse reaction systems underscore its utility in organic synthesis. The product is typically supplied as a high-purity solid, ensuring reliable performance in demanding synthetic workflows.
(4-(Benzyloxy)-2-(trifluoromethyl)phenyl)boronic acid structure
1217501-32-0 structure
Product Name:(4-(Benzyloxy)-2-(trifluoromethyl)phenyl)boronic acid
CAS No:1217501-32-0
MF:C14H12BF3O3
MW:296.049494743347
MDL:MFCD13195652
CID:827742
Update Time:2025-10-18

(4-(Benzyloxy)-2-(trifluoromethyl)phenyl)boronic acid Chemical and Physical Properties

Names and Identifiers

    • (4-(Benzyloxy)-2-(trifluoromethyl)phenyl)boronic acid
    • 4-(Benzyloxy)-2-(trifluoromethyl)phenylboronic acid
    • 4-Benzyloxy-2-trifluoromethylphenylboronic acid
    • [4-phenylmethoxy-2-(trifluoromethyl)phenyl]boronic acid
    • MDL： MFCD13195652
    • Inchi： 1S/C14H12BF3O3/c16-14(17,18)12-8-11(6-7-13(12)15(19)20)21-9-10-4-2-1-3-5-10/h1-8,19-20H,9H2
    • InChI Key： PFRQXVBDZOMJDK-UHFFFAOYSA-N
    • SMILES： FC(C1C=C(C=CC=1B(O)O)OCC1C=CC=CC=1)(F)F

Computed Properties

  • Exact Mass: 296.08300
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 5

Experimental Properties

  • PSA: 49.69000
  • LogP: 1.96420

(4-(Benzyloxy)-2-(trifluoromethyl)phenyl)boronic acid Security Information

  • Hazard Category Code： 22
  • Hazardous Material Identification： Xn

(4-(Benzyloxy)-2-(trifluoromethyl)phenyl)boronic acid Customs Data

  • HS CODE：2931900090
  • Customs Data：

    China Customs Code:

    2931900090

    Overview:

    2931900090. Other organic-Inorganic compound. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:AB(Customs clearance form for Inbound Goods,Customs clearance form for outbound goods). MFN tariff:6.5%. general tariff:30.0%

    Summary:

    2931900090. other organo-inorganic compounds. VAT:17.0%. Tax rebate rate:13.0%. Supervision conditions:AB(certificate of inspection for goods inward,certificate of inspection for goods outward). MFN tariff:6.5%. General tariff:30.0%

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(4-(Benzyloxy)-2-(trifluoromethyl)phenyl)boronic acid Related Literature

Additional information on (4-(Benzyloxy)-2-(trifluoromethyl)phenyl)boronic acid

Comprehensive Overview of (4-(Benzyloxy)-2-(trifluoromethyl)phenyl)boronic acid (CAS No. 1217501-32-0)

(4-(Benzyloxy)-2-(trifluoromethyl)phenyl)boronic acid (CAS No. 1217501-32-0) is a specialized boronic acid derivative widely utilized in organic synthesis, pharmaceutical research, and material science. This compound features a benzyloxy group and a trifluoromethyl substituent, which enhance its reactivity and applicability in cross-coupling reactions, such as the Suzuki-Miyaura reaction. Its unique structure makes it a valuable intermediate for constructing complex molecules, particularly in drug discovery and agrochemical development.

The growing interest in boronic acid compounds stems from their versatility in forming stable covalent bonds with diols and other nucleophiles, a property exploited in sensor development and bioconjugation. Researchers frequently search for "boronic acid applications in medicine" or "how to synthesize (4-(Benzyloxy)-2-(trifluoromethyl)phenyl)boronic acid," reflecting its relevance in cutting-edge science. The compound's trifluoromethyl group also aligns with trends in fluorine chemistry, a hotspot due to fluorine's ability to improve metabolic stability and bioavailability in pharmaceuticals.

In the context of green chemistry, (4-(Benzyloxy)-2-(trifluoromethyl)phenyl)boronic acid is often discussed for its role in catalytic processes that reduce waste and energy consumption. Queries like "eco-friendly boronic acid reactions" highlight this demand. Additionally, its benzyl-protected hydroxyl moiety offers selective deprotection strategies, a topic frequently explored in "protecting group chemistry tutorials."

From a commercial perspective, CAS No. 1217501-32-0 is supplied by leading chemical vendors with >95% purity, catering to industries prioritizing high-precision synthesis. Analytical techniques such as HPLC, NMR, and mass spectrometry are critical for quality control, as noted in searches for "how to characterize boronic acid derivatives." Storage recommendations typically emphasize anhydrous conditions to preserve the compound's integrity, addressing common concerns like "boronic acid stability under air."

Future directions for (4-(Benzyloxy)-2-(trifluoromethyl)phenyl)boronic acid include its integration into metal-organic frameworks (MOFs) and drug-delivery systems, areas gaining traction in academic and industrial research. As synthetic methodologies advance, this compound is poised to play a pivotal role in innovations spanning catalysis, materials science, and biomedical engineering.

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