Potassium 2,6-dimethoxypyridine-3-trifluoroborate

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Product Information

Molecular Formula:
C7H8BF3KNO2
Molecular Weight:
245.05
Description
Potassium 2,6-dimethoxypyridine-3-trifluoroborate is a pivotal reagent extensively employed in the fabrication of diversified pharmaceuticals and agrochemicals. It assumes the role of a critical intermediary within the realm of potential drug candidates dedicated to the amelioration of neurological disorders, inflammatory diseases, and cancer.
Synonyms
Potassium 2,6-dimethoxy-3-pyridinetrifluoroborate
IUPAC Name
potassium(2,6-dimethoxypyridin-3-yl)-trifluoroboranuide
Canonical SMILES
[B-](C1=C(N=C(C=C1)OC)OC)(F)(F)F.[K+]
InChI
InChI=1S/C7H8BF3NO2.K/c1-13-6-4-3-5(8(9,10)11)7(12-6)14-2/h3-4H,1-2H3/q-1+1
InChI Key
OOZVNYRZKSCHOM-UHFFFAOYSA-N
Melting Point
271-276 °C
Flash Point
Not applicable
Purity
97%
Storage
2-8°C

Safety Information

Hazards
H315 - H319 - H335
Precautionary Statement
P261 - P305 + P351 + P338

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
7
Rotatable Bond Count
2
Exact Mass
245.0237246 g/mol
Monoisotopic Mass
245.0237246 g/mol
Topological Polar Surface Area
31.4Ų
Heavy Atom Count
15
Formal Charge
0
Complexity
196
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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