Potassium 2-methoxyphenyltrifluoroborate

Product Information

Molecular Formula:
CH3OC6H4BF3K
Molecular Weight:
214.03
Description
Potassium 2-methoxyphenyltrifluoroborate is a crucial entity extensively employed within the biomedical sector and manifests as a paramount compound for the synthesis of pharmaceutical agents, specifically designed to tackle distinct maladies. Its inherent adaptability facilitates the creation of remedies to combat diverse afflictions encompassing oncological, cardiac, and neurological impediments.
Synonyms
Potassium (2-Methoxyphenyl)trifluoroborate; Potassium trifluoro(2-methoxyphenyl)borate; Potassium 2-methoxyphenyltrifluoroborate; potassium; trifluoro-(2-methoxyphenyl)boranuide; POTASSIUM TRIFLUORO(2-METHOXYPHENYL)BORANUIDE; Potassium(2-Methoxyphenyl)trifluoroborate; Borate(1-), trifluoro(2-methoxyphenyl)-, potassium (1:1), (T-4)-; Trifluoro(2-methoxyphenyl)potassioboron(V); P1810; potassium trifluoro-(2-methoxyphenyl)boranuide; Potassium trifluoro(2-methoxyphenyl)borate(1-); potassium tris(fluoranyl)-(2-methoxyphenyl)boranuide
IUPAC Name
potassiumtrifluoro-(2-methoxyphenyl)boranuide
Canonical SMILES
[B-](C1=CC=CC=C1OC)(F)(F)F.[K+]
InChI
InChI=1S/C7H7BF3O.K/c1-12-7-5-3-2-4-6(7)8(9,10)11/h2-5H,1H3/q-1+1
InChI Key
IXJPOOXJHKETAZ-UHFFFAOYSA-N
Melting Point
>230 °C
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
1
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
153
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-2014362150-A1 Sulfonamide derivative or pharmaceutically acceptable acid addition salt thereof 2013-12-12
CA-2933147-A1 Sulfonamide derivative or pharmaceutically acceptable acid addition salt thereof 2013-12-12
EP-3081553-A1 Sulfonamide derivative or pharmaceutically acceptable acid addition salt thereof 2013-12-12
EP-3081553-B1 Sulfonamide derivative or pharmaceutically acceptable acid addition salt thereof 2013-12-12
US-2016362376-A1 Sulfonamide derivative or pharmaceutically acceptable acid addition salt thereof 2013-12-12
US-9815787-B2 Sulfonamide derivative or pharmaceutically acceptable acid addition salt thereof 2013-12-12
AU-2013340896-A1 Pressure process 2012-10-31
AU-2013340896-A2 Pressure process 2012-10-31
AU-2013340896-B2 Pressure process 2012-10-31
EP-2914563-A1 Pressure process 2012-10-31
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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