Potassium 2-fluoro-5-formylphenyltrifluoroborate

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Product Information

Molecular Formula:
C7H4BF4KO
Molecular Weight:
230.01
Description
Organotrifluoroborate involved in: Metal-free chlorodeboronation; Hydrolysis via silica gel and water; Suzuki-Miyaura reactions; Reductive amination; Wittig reactionsOrganotrifluoroborates as versatile and stable boronic acid surrogates.
Synonyms
potassium;trifluoro-(2-fluoro-5-formylphenyl)boranuide
IUPAC Name
potassium;trifluoro-(2-fluoro-5-formylphenyl)boranuide
Canonical SMILES
[B-](C1=C(C=CC(=C1)C=O)F)(F)(F)F.[K+]
InChI
InChI=1S/C7H4BF4O.K/c9-7-2-1-5(4-13)3-6(7)8(10,11)12;/h1-4H;/q-1;+1
InChI Key
HCTPXGYDPRWOOU-UHFFFAOYSA-N
Melting Point
230-235 °C
Flash Point
Not applicable
Purity
95 %
LogP
1.69260

Safety Information

Hazards
H315 - H319 - H335
Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
6
Rotatable Bond Count
1
Exact Mass
229.9928390 g/mol
Monoisotopic Mass
229.9928390 g/mol
Topological Polar Surface Area
17.1Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
199
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
AU-2013340896-A1 Pressure process 2012-10-31
AU-2013340896-A2 Pressure process 2012-10-31
AU-2013340896-B2 Pressure process 2012-10-31
JP-2016500645-A Printing method 2012-10-31
JP-6353455-B2 Printing method 2012-10-31
KR-102104692-B1 Printing method 2012-10-31
US-9908819-B1 Printing method for production a ceramic green body 2012-10-31
The molarity calculator equation

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

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The dilution calculator equation

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

This equation is commonly abbreviated as: C1V1 = C2V2

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