Potassium phenoxymethyltrifluoroborate

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Product Information

Molecular Formula:
C7H7BF3KO
Molecular Weight:
214.03
Description
Organotrifluoroborates as versatile and stable boronic acid surrogates.
Synonyms
potassium; trifluoro(phenoxymethyl)boranuide; POTASSIUMPHENOXY-METHYLTRIFLUOROBORATE; PubChem11600; MLS002705544; CHEMBL2135322
IUPAC Name
potassiumtrifluoro(phenoxymethyl)boranuide
Canonical SMILES
[B-](COC1=CC=CC=C1)(F)(F)F.[K+]
InChI
InChI=1S/C7H7BF3O.K/c9-8(10,11)6-12-7-4-2-1-3-5-7;/h1-5H,6H2;/q-1;+1
InChI Key
OVYSNXCRBZPJIG-UHFFFAOYSA-N
Melting Point
>300 °C
Flash Point
Not applicable
Purity
95%

Safety Information

Hazards
H315 - H319 - H335
Precautionary Statement
P261 - P305 + P351 + P338

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
2
Exact Mass
214.0179110 g/mol
Monoisotopic Mass
214.0179110 g/mol
Topological Polar Surface Area
9.2Ų
Heavy Atom Count
13
Formal Charge
0
Complexity
136
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
CN-107001273-B Pyridine derivatives 2014-12-05
EP-3228616-A1 Pyridine derivatives 2014-12-05
EP-3228616-B1 Pyridine derivatives 2014-12-05
ES-2755476-T3 Pyridine derivatives 2014-12-05
JP-6626001-B2 Pyridine derivatives 2014-12-05
JP-WO2016088864-A1 Pyridine derivatives 2014-12-05
US-10005762-B2 Pyridine derivatives 2014-12-05
US-2017362209-A1 Pyridine derivatives 2014-12-05
WO-2016088864-A1 Pyridine derivative 2014-12-05
AU-2013340896-A1 Pressure process 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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