Potassium benzofurazan-5-trifluoroborate
Product Information
Molecular Formula
C6H3BF3KN2O
Molecular Weight
226.01
Description
Organotrifluoroborate invovled in copper-mediated cross-coupling and Suzuki cross-couplingOrganotrifluoroborates as versatile and stable boronic acid surrogates.
Synonyms
Potassium benzo[c][1,2,5]oxadiazole-5-trifluoroborate
IUPAC Name
potassium2,1,3-benzoxadiazol-5-yl(trifluoro)boranuide
SMILES
[B-](C1=CC2=NON=C2C=C1)(F)(F)F.[K+]
InChI
InChI=1S/C6H3BF3N2O.K/c8-7(9,10)4-1-2-5-6(3-4)12-13-11-5/h1-3H/q-1+1
InChI Key
VVXGHNBCIPLVLI-UHFFFAOYSA-N
Melting Point
>300 °C
Flash Point
Not applicable
Purity
96%
Safety Information
Hazards
H315 - H319 - H335
Precautionary Statement
P302 + P352 - P305 + P351 + P338
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
7
Rotatable Bond Count
0
Exact Mass
225.9927589 g/mol
Monoisotopic Mass
225.9927589 g/mol
Topological Polar Surface Area
38.9Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
206
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 |
| EP-2914563-A1 | Pressure process | 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 |
| WO-2014067990-A1 | Pressure process | 2012-10-31 |
| ES-2891096-T3 | Printing procedure | 2012-10-31 |
