Potassium Trifluoro(6-fluoro-3-pyridyl)borate - CAS 1111732-94-5

Catalog:	BB002731
Product Name:	Potassium Trifluoro(6-fluoro-3-pyridyl)borate
CAS:	1111732-94-5
Synonyms:	potassium;trifluoro-(6-fluoro-3-pyridinyl)boranuide; potassium;trifluoro-(6-fluoropyridin-3-yl)boranuide

Technical Data

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Patents

Computed Properties

IUPAC Name:	potassium;trifluoro-(6-fluoropyridin-3-yl)boranuide
Description:	Potassium Trifluoro(6-fluoro-3-pyridyl)borate (CAS# 1111732-94-5) is a useful research chemical.
Molecular Weight:	202.99
Molecular Formula:	C5H3F4NBK
Canonical SMILES:	[B-](C1=CN=C(C=C1)F)(F)(F)F.[K+]
InChI:	InChI=1S/C5H3BF4N.K/c7-5-2-1-4(3-11-5)6(8,9)10;/h1-3H;/q-1;+1
InChI Key:	FRIUXLLFAUQFID-UHFFFAOYSA-N
LogP:	1.27510

Publication Number	Title	Priority Date
AU-2013340896-A1	Pressure process	20121031
AU-2013340896-A2	Pressure process	20121031
AU-2013340896-B2	Pressure process	20121031
EP-2914563-A1	Pressure process	20121031
JP-2016500645-A	Printing method	20121031

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Related Functional Groups

Boronic Acids and Esters

[1256355-43-7]
2-(Methoxycarbonyl)-4-methylphenylboronic Acid
[380430-53-5]
2-Ethoxycarbonylphenylboronic Acid
[163105-90-6]
2-Methoxy-3-pyridylboronic Acid
[10365-98-7]
3-Methoxybenzeneboronic Acid
[364044-44-0]
4'-Chloro-4-biphenylboronic Acid
[1450835-21-8]
(6-Chlorobenzo[b]thiophen-2-yl)boronic acid

GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	142
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	202.9931734
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	6
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	202.9931734
Rotatable Bond Count:	0
Topological Polar Surface Area:	12.9
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0