Potassium Trifluoro[4-(trifluoromethyl)phenyl]borate
Product Information
Molecular Formula
C7H4F6BK
Molecular Weight
252.01
Description
Potassium Trifluoro[4-(trifluoromethyl)phenyl]borate (CAS# 166328-08-1) is a useful research chemical.
Synonyms
potassium;trifluoro-[4-(trifluoromethyl)phenyl]boranuide; potassium;trifluoro-[4-(trifluoromethyl)phenyl]boranuide
IUPAC Name
potassium;trifluoro-[4-(trifluoromethyl)phenyl]boranuide
SMILES
[B-](C1=CC=C(C=C1)C(F)(F)F)(F)(F)F.[K+]
InChI
InChI=1S/C7H4BF6.K/c9-7(10,11)5-1-3-6(4-2-5)8(12,13)14;/h1-4H;/q-1;+1
InChI Key
KVDSXGFQLXKOID-UHFFFAOYSA-N
Melting Point
>300 °C (lit.)
Purity
96 %
Appearance
White to off-white powder
LogP
2.75980
Safety Information
Hazards
H315-H319-H335
Precautionary Statement
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word
Warning
Computed Properties
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
7
Rotatable Bond Count
0
Exact Mass
251.9947308 g/mol
Monoisotopic Mass
251.9947308 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
15
Formal Charge
0
Complexity
193
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-2015233654-A1 | Heteroaryl Syk inhibitors | 2014-03-19 |
| AU-2015233654-B2 | Heteroaryl Syk inhibitors | 2014-03-19 |
| CA-2942997-A1 | Heteroaryl syk inhibitors | 2014-03-19 |
| CN-110713489-A | Heteroaryl SYK inhibitors | 2014-03-19 |
| EA-032097-B1 | SYK HETEROARIAL INHIBITORS | 2014-03-19 |
| EP-3119765-A1 | Heteroaryl syk inhibitors | 2014-03-19 |
| EP-3119765-B1 | Heteroaryl syk inhibitors | 2014-03-19 |
| EP-3119772-A1 | Heteroaryl sik inhibitors | 2014-03-19 |
| EP-3119772-B1 | Heteroaryl sik inhibitors | 2014-03-19 |
| JP-2017511805-A | Heteroaryl SYK inhibitor | 2014-03-19 |
