POTASSIUM (2-NITROPHENYL)TRIFLUOROBORATE
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
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 |
