Potassium (4-Cyanophenyl)trifluoroborate - CAS 850623-36-8

Catalog:	BB037444
Product Name:	Potassium (4-Cyanophenyl)trifluoroborate
CAS:	850623-36-8
Synonyms:	potassium;(4-cyanophenyl)-trifluoroboranuide; potassium;(4-cyanophenyl)-trifluoroboranuide

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Computed Properties

IUPAC Name:	potassium;(4-cyanophenyl)-trifluoroboranuide
Description:	Potassium (4-Cyanophenyl)trifluoroborate (CAS# 850623-36-8) is a useful research chemical.
Molecular Weight:	209.02
Molecular Formula:	C7H4F3NBK
Canonical SMILES:	[B-](C1=CC=C(C=C1)C#N)(F)(F)F.[K+]
InChI:	InChI=1S/C7H4BF3N.K/c9-8(10,11)7-3-1-6(5-12)2-4-7;/h1-4H;/q-1;+1
InChI Key:	JEQAKQWNUUSKHI-UHFFFAOYSA-N
LogP:	1.61268

Publication Number	Title	Priority Date
CN-111620896-A	Preparation method of tetra-coordinated N, N-chelated diaryl borate compound with 8-aminoquinoline derivative as bidentate ligand	20200611
WO-2020205765-A1	Carbazole and acridine photoredox catalysts for small molecule and macromolecular transformations	20190329
US-2020085810-A1	Compounds for use in treating kidney disorders	20180726
WO-2020021097-A1	Compounds for use in treating kidney disorders	20180726
AU-2019310919-A1	Compounds for use in treating kidney disorders	20180726

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Related Functional Groups

Boronic Acids and Esters

[1256355-43-7]
2-(Methoxycarbonyl)-4-methylphenylboronic Acid
[871126-22-6]
2-Fluoro-4-formylphenylboronic acid
[881302-73-4]
3,5-Dicarboxyphenylboronic Acid
[470478-90-1]
4-(4-Boc-piperazino)phenylboronic Acid Pinacol Ester
[850623-36-8]
Potassium (4-Cyanophenyl)trifluoroborate
[1171897-39-4]
5-(Boc-amino)pyridine-3-boronic Acid Pinacol Ester

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GHS Hazard Statement:	H302 (13.64%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P322, P330, P332+P313, P337+P313, P362, P363, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	202
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	209.0025953
Formal Charge:	0
Heavy Atom Count:	13
Hydrogen Bond Acceptor Count:	5
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	209.0025953
Rotatable Bond Count:	0
Topological Polar Surface Area:	23.8 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0