Potassium Trifluoro(3-iodophenyl)borate - CAS 1189097-36-6

Catalog:	BB004330
Product Name:	Potassium Trifluoro(3-iodophenyl)borate
CAS:	1189097-36-6
Synonyms:	potassium;trifluoro-(3-iodophenyl)boranuide; potassium;trifluoro-(3-iodophenyl)boranuide

Technical Data

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Computed Properties

IUPAC Name:	potassium;trifluoro-(3-iodophenyl)boranuide
Description:	Potassium Trifluoro(3-iodophenyl)borate (CAS# 1189097-36-6) is a useful research chemical.
Molecular Weight:	309.90
Molecular Formula:	C6H4F3IBK
Canonical SMILES:	[B-](C1=CC(=CC=C1)I)(F)(F)F.[K+]
InChI:	InChI=1S/C6H4BF3I.K/c8-7(9,10)5-2-1-3-6(11)4-5;/h1-4H;/q-1;+1
InChI Key:	OREURDWJZUTVFM-UHFFFAOYSA-N
MDL:	MFCD09800739
LogP:	2.34560

Publication Number	Title	Priority Date
CA-2921880-A1	Alkynyl alcohols and methods of use	20130822
CA-2921881-A1	Alkynyl alcohols and methods of use	20130822
EP-3036229-A1	Alkynyl alcohols and methods of use	20130822
EP-3036230-A1	Alkynyl alcohols and methods of use	20130822
US-2015057260-A1	Alkynyl alcohols and methods of use	20130822

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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P312, P304+P340, P312, P322, P330, P363, and P501
Signal Word:	Warning

Complexity:	141
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	309.90399
Formal Charge:	0
Heavy Atom Count:	12
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	309.90399
Rotatable Bond Count:	0
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0