Cas no 480438-59-3 ((4-Fluoro-2-isopropoxyphenyl)boronic acid)

(4-Fluoro-2-isopropoxyphenyl)boronic acid is a versatile boronic acid derivative widely used in Suzuki-Miyaura cross-coupling reactions, a key method for forming carbon-carbon bonds in organic synthesis. The fluorine substituent enhances its reactivity and stability, while the isopropoxy group influences steric and electronic properties, making it valuable for constructing complex aryl frameworks. This compound exhibits good solubility in common organic solvents, facilitating its use in homogeneous catalytic systems. Its high purity and consistent performance make it a reliable reagent for pharmaceutical and materials science research. Proper handling under inert conditions is recommended to preserve its stability and reactivity.
(4-Fluoro-2-isopropoxyphenyl)boronic acid structure
480438-59-3 structure
Product Name:(4-Fluoro-2-isopropoxyphenyl)boronic acid
CAS No:480438-59-3
MF:C9H12BFO3
MW:197.999186515808
MDL:MFCD06411287
CID:828901
PubChem ID:24880185
Update Time:2025-05-26

(4-Fluoro-2-isopropoxyphenyl)boronic acid Chemical and Physical Properties

Names and Identifiers

    • (4-Fluoro-2-isopropoxyphenyl)boronic acid
    • 4-Fluoro-2-isopropoxybenzeneboronic acid
    • 4-Fluoro-2-isopropoxyphenylboronic acid
    • (4-fluoro-2-propan-2-yloxyphenyl)boronic acid
    • D71342
    • AKOS015853476
    • CS-0059267
    • B-[4-Fluoro-2-(1-methylethoxy)phenyl]boronic acid
    • DB-384614
    • DTXSID70584281
    • BP-20270
    • 4-fluoro-2-isopropoxybenzene boronic acid
    • (4-Fluoro-2-isopropoxy-phenyl)boronic acid
    • RSEFJQODCQCGRB-UHFFFAOYSA-N
    • AS-65064
    • 480438-59-3
    • MFCD06411287
    • SCHEMBL2462591
    • 4-FLUORO-2-ISOPROPOXYBENZENEBORONIC ACID, 97%
    • AB25194
    • {4-Fluoro-2-[(propan-2-yl)oxy]phenyl}boronic acid
    • (4-Fluoro-2-isopropoxyphenyl)boronicacid
    • [4-FLUORO-2-(PROPAN-2-YLOXY)PHENYL]BORONIC ACID
    • MDL: MFCD06411287
    • Inchi: 1S/C9H12BFO3/c1-6(2)14-9-5-7(11)3-4-8(9)10(12)13/h3-6,12-13H,1-2H3
    • InChI Key: RSEFJQODCQCGRB-UHFFFAOYSA-N
    • SMILES: FC1C=CC(B(O)O)=C(C=1)OC(C)C

Computed Properties

  • Exact Mass: 198.08600
  • Monoisotopic Mass: 198.0863526g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 3
  • Complexity: 177
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: nothing
  • Topological Polar Surface Area: 49.7?2

Experimental Properties

  • Density: 1.17
  • Melting Point: 101-106?°C (lit.)
  • Boiling Point: 312.7°C at 760 mmHg
  • Flash Point: 142.9°C
  • Refractive Index: 1.495
  • PSA: 49.69000
  • LogP: 0.29270

(4-Fluoro-2-isopropoxyphenyl)boronic acid Security Information

  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3

(4-Fluoro-2-isopropoxyphenyl)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%

(4-Fluoro-2-isopropoxyphenyl)boronic acid Pricemore >>

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