Cas no 1638533-83-1 (potassium (3-ethoxyphenyl)trifluoroboranuide)

Potassium (3-ethoxyphenyl)trifluoroboranuide is an organoboron reagent commonly used in cross-coupling reactions, such as Suzuki-Miyaura couplings, due to its stability and reactivity. The trifluoroborate moiety enhances shelf life and handling compared to boronic acids, while the ethoxy substituent influences electronic properties, facilitating selective transformations. This compound is particularly valuable in pharmaceutical and agrochemical synthesis, where controlled functionalization of aromatic systems is required. Its crystalline solid form ensures consistent purity and ease of storage. Compatibility with aqueous and mild reaction conditions further broadens its utility in diverse synthetic pathways. Proper handling under inert conditions is recommended to maintain stability.
potassium (3-ethoxyphenyl)trifluoroboranuide structure
1638533-83-1 structure
Product Name:potassium (3-ethoxyphenyl)trifluoroboranuide
CAS No:1638533-83-1
MF:C8H9BF3KO
MW:228.060973882675
MDL:MFCD09993311
CID:4610127
PubChem ID:63675453
Update Time:2025-06-08

potassium (3-ethoxyphenyl)trifluoroboranuide Chemical and Physical Properties

Names and Identifiers

    • potassium(3-ethoxyphenyl)trifluoroboranuide
    • Potassium 3-ethoxyphenyltrifluoroborate
    • Potassium (3-Ethoxyphenyl)trifluoroboranuide
    • potassium (3-ethoxyphenyl)trifluoroboranuide
    • MDL: MFCD09993311
    • Inchi: 1S/C8H9BF3O.K/c1-2-13-8-5-3-4-7(6-8)9(10,11)12;/h3-6H,2H2,1H3;/q-1;+1
    • InChI Key: SLMPDCHYZDCWCP-UHFFFAOYSA-N
    • SMILES: [K+].[B-](C1=CC=CC(OCC)=C1)(F)(F)F

Computed Properties

  • Exact Mass: 228.034
  • Monoisotopic Mass: 228.034
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 165
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 9.2A^2

potassium (3-ethoxyphenyl)trifluoroboranuide Security Information

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Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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abcr
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