POTASSIUM (2-NITROPHENYL)TRIFLUOROBORATE

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Product Information

Molecular Formula:
C6H4BF3KNO2
Molecular Weight:
229.01
Description
Organotrifluoroborates as versatile and stable boronic acid surrogates.
Synonyms
POTASSIUM (2-NITROPHENYL)TRIFLUOROBORATE
IUPAC Name
potassiumtrifluoro-(2-nitrophenyl)boranuide
Canonical SMILES
[B-](C1=CC=CC=C1[N+](=O)[O-])(F)(F)F.[K+]
InChI
InChI=1S/C6H4BF3NO2.K/c8-7(9,10)5-3-1-2-4-6(5)11(12)13/h1-4H/q-1+1
InChI Key
DZHYOFKWMHZKBK-UHFFFAOYSA-N
Melting Point
265-270 °C
Flash Point
Not applicable
Purity
97%

Safety Information

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

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
6
Rotatable Bond Count
0
Exact Mass
228.9924245 g/mol
Monoisotopic Mass
228.9924245 g/mol
Topological Polar Surface Area
45.8Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
203
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
US-2014275563-A1 Preparation of 1,3-(substituted-diaryl)-1,2,4-triazoles and intermediates therefrom 2013-03-13
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
JP-2016500645-A Printing method 2012-10-31
JP-6353455-B2 Printing method 2012-10-31
KR-102104692-B1 Printing method 2012-10-31
KR-20150076164-A 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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