Potassium Trifluoro(4-isoquinolinyl)borate

Inquiry

Molecular Formula:

C9H6F3NBK

Molecular Weight:

235.06

CAS Number:

1111733-07-3

Catalog Number:

1111733-07-3

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

Canonical 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

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

235.0182453 g/mol

Monoisotopic Mass

235.0182453 g/mol

Topological Polar Surface Area

12.9Å²

Heavy Atom Count

Formal Charge

Complexity

212

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

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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Potassium Trifluoro(4-isoquinolinyl)borate

Product Information

Safety Information

Computed Properties

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