Potassium Trifluoro(4-hydroxyphenyl)borate
Product Information
Molecular Formula
C6H5F3OBK
Molecular Weight
200.01
Description
Potassium Trifluoro(4-hydroxyphenyl)borate (CAS# 1015082-71-9) is a useful research chemical.
Synonyms
potassium;trifluoro-(4-hydroxyphenyl)boranuide; potassium;trifluoro-(4-hydroxyphenyl)boranuide
IUPAC Name
potassium;trifluoro-(4-hydroxyphenyl)boranuide
SMILES
[B-](C1=CC=C(C=C1)O)(F)(F)F.[K+]
InChI
InChI=1S/C6H5BF3O.K/c8-7(9,10)5-1-3-6(11)4-2-5;/h1-4,11H;/q-1;+1
InChI Key
WLZQZSRIHYVYCS-UHFFFAOYSA-N
Melting Point
288-293 °C
Flash Point
Not applicable
Purity
95 %
Appearance
Solid
LogP
1.44660
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
1
Hydrogen Bond Acceptor Count
5
Rotatable Bond Count
0
Exact Mass
200.0022609 g/mol
Monoisotopic Mass
200.0022609 g/mol
Topological Polar Surface Area
20.2Ų
Heavy Atom Count
12
Formal Charge
0
Complexity
133
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-100932531-B1 | Potassium organotrifluoroborate derivatives and preparation method thereof | 2008-02-04 |
| KR-20090085200-A | Potassium organotrifluoroborate derivatives and preparation method thereof | 2008-02-04 |
| US-2011004023-A1 | Potassium Organotrifluoroborate Derivative and a Production Method Therefor | 2008-02-04 |
| US-8513465-B2 | Potassium organotrifluoroborate derivative and a production method therefor | 2008-02-04 |
| WO-2009099291-A2 | Potassium organotrifluoroborate derivative and a production method therefor | 2008-02-04 |
