Cas no 397843-61-7 (4-(Phenoxymethyl)phenylboronic Acid)

4-(Phenoxymethyl)phenylboronic acid is a boronic acid derivative featuring a phenoxymethyl substituent on the phenyl ring. This compound is widely utilized in Suzuki-Miyaura cross-coupling reactions, where it serves as a key intermediate for synthesizing biaryl structures. Its boronic acid group enables efficient transmetalation with palladium catalysts, while the phenoxymethyl moiety enhances solubility and stability in organic solvents. The compound is particularly valuable in pharmaceutical and materials science research for constructing complex aromatic systems. High purity and consistent reactivity make it a reliable choice for precision synthesis. Proper handling under inert conditions is recommended to preserve its boronic acid functionality.
4-(Phenoxymethyl)phenylboronic Acid structure
397843-61-7 structure
Product Name:4-(Phenoxymethyl)phenylboronic Acid
CAS No:397843-61-7
MF:C13H13BO3
MW:228.051523923874
MDL:MFCD09966155
CID:299823
PubChem ID:10955308
Update Time:2025-10-06

4-(Phenoxymethyl)phenylboronic Acid Chemical and Physical Properties

Names and Identifiers

    • (4-(Phenoxymethyl)phenyl)boronic acid
    • [4-(phenoxymethyl)phenyl]boronic acid
    • 4-(Phenoxymethyl)phenylboronic acid
    • Boronic acid,B-[4-(phenoxymethyl)phenyl]-
    • ACMC-1AEGD
    • ANW-75486
    • CC63712
    • MolPort-000-144-007
    • SBB097226
    • SureCN177615
    • MFCD09966155
    • 397843-61-7
    • SCHEMBL177615
    • F77563
    • BS-28176
    • DTXSID50449703
    • (4-(Phenoxymethyl)phenyl)boronicacid
    • CS-0174664
    • 4-(phenoxymethyl)phenylboronic acid, AldrichCPR
    • AKOS005974755
    • XQA84361
    • FT-0717301
    • DB-069871
    • 4-(Phenoxymethyl)phenylboronic Acid
    • MDL: MFCD09966155
    • Inchi: 1S/C13H13BO3/c15-14(16)12-8-6-11(7-9-12)10-17-13-4-2-1-3-5-13/h1-9,15-16H,10H2
    • InChI Key: IXDHTLPOOZIZJX-UHFFFAOYSA-N
    • SMILES: O(C1C=CC=CC=1)CC1C=CC(B(O)O)=CC=1

Computed Properties

  • Exact Mass: 228.09600
  • Monoisotopic Mass: 228.0957744g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 4
  • Complexity: 209
  • 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
  • Topological Polar Surface Area: 49.7?2

Experimental Properties

  • PSA: 49.69000
  • LogP: 0.94540

4-(Phenoxymethyl)phenylboronic Acid Security Information

  • Hazard Category Code: 36
  • Safety Instruction: 26
  • Hazardous Material Identification: Xi

4-(Phenoxymethyl)phenylboronic 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%

4-(Phenoxymethyl)phenylboronic Acid Pricemore >>

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