Potassium Allyltrifluoroborate - CAS 233664-53-4

Name: Potassium Allyltrifluoroborate
Brand: BOC Sciences
Rating: 5 (1 reviews)

Catalog:	BB018021
Product Name:	Potassium Allyltrifluoroborate
CAS:	233664-53-4
Synonyms:	potassium;trifluoro(prop-2-enyl)boranuide; potassium;trifluoro(prop-2-enyl)boranuide

Technical Data

IUPAC Name:	potassium;trifluoro(prop-2-enyl)boranuide
Description:	Organotrifluoroborate involved in: Catalytic allylboration; Stereoselective nucleophilic addition; Pd-catalyzed heterocyclizations; Oxidation reactions and Oxidative Mannich reactions; Cross-coupling reactionsOrganotrifluoroborates as versatile and stable boronic acid surrogates.
Molecular Weight:	147.98
Molecular Formula:	C3H5F3BK
Canonical SMILES:	[B-](CC=C)(F)(F)F.[K+]
InChI:	InChI=1S/C3H5BF3.K/c1-2-3-4(5,6)7;/h2H,1,3H2;/q-1;+1
InChI Key:	TVPZAMJXLCDMIT-UHFFFAOYSA-N
Melting Point:	>300 °C
Flash Point:	Not applicable
Purity:	95 %
MDL:	MFCD07368222
LogP:	2.01980

GHS Hazard Statement:	H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
Precautionary Statement:	P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P310, P312, P321, P332+P313, P362, P403+P233, P405, and P501
Signal Word:	Danger

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Complexity:	69.4
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	148.0073463
Formal Charge:	0
Heavy Atom Count:	8
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	0
Isotope Atom Count:	0
Monoisotopic Mass:	148.0073463
Rotatable Bond Count:	1
Topological Polar Surface Area:	0 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0