Potassium isopropenyltrifluoroborate

Product Information

Molecular Formula:
C3H5BF3.K
Molecular Weight:
147.975
Description
Potassium isopropenyltrifluoroborate is a highly versatile compound that finds extensive usage in the biomedical industry. Its main function lies in serving as a reagent to enable a plethora of organic reactions, including cross-coupling reactions and palladium catalysis. Notably, this reagent assumes a pivotal role in synthesizing pharmaceutical compounds, agrochemicals, and fine chemicals.
Synonyms
Potassium isopropenyltrifluoroborate
IUPAC Name
potassiumtrifluoro(prop-1-en-2-yl)boranuide
Canonical SMILES
[B-](C(=C)C)(F)(F)F.[K+]
InChI
InChI=1S/C3H5BF3.K/c1-3(2)4(5,6)7/h1H2,2H3/q-1+1
InChI Key
QKBZHQPFHGKCOX-UHFFFAOYSA-N
Melting Point
274-280 °C
Flash Point
Not applicable
Purity
97%

Safety Information

Hazards
H314
Precautionary Statement
P280 - P305 + P351 + P338 - P310

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
4
Rotatable Bond Count
0
Exact Mass
148.0073463 g/mol
Monoisotopic Mass
148.0073463 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
8
Formal Charge
0
Complexity
87
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
2
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
WO-2021257804-A1 Thyromimetics 2020-06-17
WO-2021239643-A1 Benzylamine derivatives as ddrs inhibitors 2020-05-25
WO-2021222353-A1 Macrocyclic inhibitors of peptidylarginine deiminases 2020-04-30
WO-2021203028-A1 7- or 8-hydroxy-isoquinoline and 7- or 8-hydroxy-quinoline derivatives as alpha-1 -antitrypsin modulators for treating alpha-1 -antitrypsin deficiency (aatd) 2020-04-03
WO-2021108549-A1 Novel thyromimetics 2019-11-29
WO-2021086833-A1 Small molecule inhibitors of kras g12c mutant 2019-10-28
WO-2021080929-A1 N-(heteroaryl) quinazolin-2-amine derivatives as lrrk2 inhibitors, pharmaceutical compositions, and uses thereof 2019-10-25
WO-2021062245-A1 Pyridone compounds and methods of use in the modulation of a protein kinase 2019-09-26
WO-2020224568-A1 Cdk inhibitors 2019-05-05
AU-2020269469-A1 CDK inhibitors 2019-05-05
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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