Cas no 1242733-91-0 (Potassium pyrimidine-5-trifluoroborate)

Potassium pyrimidine-5-trifluoroborate is an organoboron reagent commonly employed in Suzuki-Miyaura cross-coupling reactions due to its stability and reactivity. The trifluoroborate moiety enhances shelf life and handling compared to boronic acids, while the pyrimidine scaffold provides a versatile heterocyclic building block for pharmaceutical and agrochemical synthesis. This compound exhibits improved solubility in organic solvents and demonstrates reliable reactivity under mild conditions, facilitating efficient C-C bond formation. Its crystalline solid form ensures consistent purity and ease of quantification in synthetic applications. The potassium counterion further enhances stability, making it a practical choice for iterative coupling strategies in complex molecule assembly.
Potassium pyrimidine-5-trifluoroborate structure
1242733-91-0 structure
Product Name:Potassium pyrimidine-5-trifluoroborate
CAS No:1242733-91-0
MF:C4H3BF3KN2
MW:185.984531641006
MDL:MFCD09992922
CID:1069344
PubChem ID:45588203
Update Time:2025-06-08

Potassium pyrimidine-5-trifluoroborate Chemical and Physical Properties

Names and Identifiers

    • Potassium pyrimidine-5-trifluoroborate
    • potassium pyrimidin-5-yltrifluoroborate
    • potassium pyrimidine-5-yltrifluoroborate
    • potassium trifluoro(pyrimidin-5-yl)boranuide
    • Pyrimidine-5-trifluoroborate potassium salt
    • Potassium trifluoro(pyrimidin-5-yl)borate
    • MDL: MFCD09992922
    • Inchi: 1S/C4H3BF3N2.K/c6-5(7,8)4-1-9-3-10-2-4;/h1-3H;/q-1;+1
    • InChI Key: FLVBHQQPIJARSC-UHFFFAOYSA-N
    • SMILES: [K+].F[B-](C1=CN=CN=C1)(F)F

Computed Properties

  • Exact Mass: 185.99800
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 11
  • Rotatable Bond Count: 1

Experimental Properties

  • Melting Point: 99-103?°C
  • PSA: 25.78000
  • LogP: 0.53100

Potassium pyrimidine-5-trifluoroborate Security Information

Potassium pyrimidine-5-trifluoroborate Pricemore >>

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Potassium pyrimidine-5-trifluoroborate Production Method

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