Potassium Trifluoro(4-isoquinolinyl)borate

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Product Information

Molecular Formula
C9H6F3NBK
Molecular Weight
235.06
Description
Potassium Trifluoro(4-isoquinolinyl)borate (CAS# 1111733-07-3) is a useful research chemical.
Synonyms
potassium;trifluoro(4-isoquinolinyl)boranuide; potassium;trifluoro(isoquinolin-4-yl)boranuide
IUPAC Name
potassium;trifluoro(isoquinolin-4-yl)boranuide
SMILES
[B-](C1=CN=CC2=CC=CC=C12)(F)(F)F.[K+]
InChI
InChI=1S/C9H6BF3N.K/c11-10(12,13)9-6-14-5-7-3-1-2-4-8(7)9;/h1-6H;/q-1;+1
InChI Key
QEIOJGBGINOBGG-UHFFFAOYSA-N
Melting Point
251-256 °C
Flash Point
Not applicable
LogP
2.28920

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
5
Rotatable Bond Count
0
Exact Mass
235.0182453 g/mol
Monoisotopic Mass
235.0182453 g/mol
Topological Polar Surface Area
12.9Ų
Heavy Atom Count
15
Formal Charge
0
Complexity
212
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
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

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The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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