POTASSIUM 4-ACETYLPHENYLTRIFLUOROBORATE&
Product Information
Molecular Formula
C8H7BF3O.K
Molecular Weight
226.045
Description
POTASSIUM 4-ACETYLPHENYLTRIFLUOROBORATE is a prominent biomedical compound extensively utilized within the pharmaceutical industry, serves as a pivotal reagent for organic synthesis and drug discovery. With its inherent potential, this compound showcases remarkable applications in combating a myriad of diseases, including cancer and neurological disorders.
Synonyms
Potassium 4-acetylphenyltrifluoroborate; potassium (4-acetylphenyl)trifluoroboranuide; POTASSIUM (4-ACETYLPHENYL)TRIFLUOROBORATE; potassium; (4-acetylphenyl)-trifluoroboranuide; POTASSIUM 4-ACETYLPHENYLTRIFLUOROBORATE&; POTASSIUM4-ACETYLPHENYLTRIFLUOROBORATE&; Trifluoro(4-acetylphenyl)potassioboron(V); Potassium (4-acetylphenyl)(trifluoro)borate(1-)
IUPAC Name
potassium(4-acetylphenyl)-trifluoroboranuide
SMILES
[B-](C1=CC=C(C=C1)C(=O)C)(F)(F)F.[K+]
InChI
InChI=1S/C8H7BF3O.K/c1-6(13)7-2-4-8(5-3-7)9(10,11)12/h2-5H,1H3/q-1+1
InChI Key
JRUXIRSHKHCTTK-UHFFFAOYSA-N
Melting Point
290 °C (dec.)
Purity
97%
Appearance
White to off-white powder or crystals
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
226.0179110 g/mol
Monoisotopic Mass
226.0179110 g/mol
Topological Polar Surface Area
17.1Ų
Heavy Atom Count
14
Formal Charge
0
Complexity
199
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 |
|---|---|---|
| KR-101492961-B1 | Justicidin a derivatives of arylnaphthalene lignan structure and method for producing the same | 2013-01-31 |
| KR-20140098466-A | Justicidin a derivatives of arylnaphthalene lignan structure and method for producing the same | 2013-01-31 |
| US-2015336938-A1 | Method for preparation of justicidin a derivatives of arylnaphthalene lignan structure | 2013-01-31 |
| US-9650355-B2 | Method for preparation of justicidin a derivatives of arylnaphthalene lignan structure | 2013-01-31 |
| WO-2014119892-A1 | Method for preparation of justicidin a derivatives of arylnaphthalene lignan structure | 2013-01-31 |
| KR-101492960-B1 | Justicidin b derivatives of arylnaphthalene lignan structure and method for producing the same | 2013-01-29 |
| KR-20140096873-A | Justicidin b derivatives of arylnaphthalene lignan structure and method for producing the same | 2013-01-29 |
| AU-2013340896-A1 | Pressure process | 2012-10-31 |
| AU-2013340896-A2 | Pressure process | 2012-10-31 |
| AU-2013340896-B2 | Pressure process | 2012-10-31 |
