Tris(pentafluorophenyl)borane

Product Information

Molecular Formula:
C18BF15
Molecular Weight:
511.98
Description
Tris(pentafluorophenyl)borane is a highly reactive reagent commonly used in biomedicine. It acts as an efficient catalyst in various organic transformations, including cross-coupling reactions and C-H activation. Additionally, it finds applications in the synthesis of pharmaceuticals, agrochemicals, and functional materials. This versatile compound facilitates the development of novel drugs and therapies to combat various diseases.
Synonyms
Perfluorotriphenylboron; tris(pentafluorophenyl)-borane
IUPAC Name
tris(2,3,4,5,6-pentafluorophenyl)borane
Canonical SMILES
B(C1=C(C(=C(C(=C1F)F)F)F)F)(C2=C(C(=C(C(=C2F)F)F)F)F)C3=C(C(=C(C(=C3F)F)F)F)F
InChI
InChI=1S/C18BF15/c20-4-1(5(21)11(27)16(32)10(4)26)19(2-6(22)12(28)17(33)13(29)7(2)23)3-8(24)14(30)18(34)15(31)9(3)25
InChI Key
OBAJXDYVZBHCGT-UHFFFAOYSA-N
Boiling Point
327.3±42.0 °C at 760 mmHg
Melting Point
126-131°C (lit.)
Purity
95%
Density
0.73 g/cm3
Solubility
soluble in Toluene
Appearance
White Powder
Storage
Store under inert gas
Refractive Index
1.42

Safety Information

Hazards
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P302+P352:
IF ON SKIN:
Wash with plenty of soap and water.
P332+P313:
If skin irritation occurs:
Get medical advice/attention.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P362+P364:
Take off contaminated clothing. [As modified by IV ATP].
And wash it before reuse. [Added by IV ATP].
Signal Word
Warning

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
15
Rotatable Bond Count
3
Exact Mass
511.9853526 g/mol
Monoisotopic Mass
511.9853526 g/mol
Topological Polar Surface Area
0Ų
Heavy Atom Count
34
Formal Charge
0
Complexity
566
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
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
CN-114133470-A Preparation method and application of alpha-diimine nickel heterogeneous catalyst loaded on olefine acid aluminum salt polymer particles 2022-01-17
CN-114106299-A Preparation method of lactone and lactide block copolymer 2021-12-31
CN-114106029-A Organic molecule containing boron-nitrogen coordination bond and preparation method thereof 2021-12-20
CN-113937223-A Preparation method of functional molecule co-doped perovskite solar cell 2021-12-15
CN-113937223-B Preparation method of functional molecule co-doped perovskite solar cell 2021-12-15
CN-114171681-A Interface modification method for remarkably improving humidity stability of perovskite solar cell 2021-12-07
CN-114160200-A Catalyst system for selective ethylene trimerization/tetramerization and preparation method and application thereof 2021-12-01
CN-114171779-A High-safety lithium ion battery and preparation method thereof 2021-11-22
CN-114069040-A Polymer electrolyte suitable for organic battery and preparation method and application thereof 2021-11-11
CN-113896894-A Branched cross-linking agent, and preparation method and application thereof 2021-11-03

Literatures

PMID Publication Date Title Journal
22934620 2012-09-12 Highly sensitive NH3 detection based on organic field-effect transistors with tris(pentafluorophenyl)borane as receptor Journal of the American Chemical Society
22511277 2012-08-14 [2.2]Paracyclophane derived bisphosphines for the activation of hydrogen by FLPs: application in domino hydrosilylation/hydrogenation of enones Dalton transactions (Cambridge, England : 2003)
22414965 2012-05-14 The structure and chemistry of tris(pentafluorophenyl)borane protected mononuclear nitridotitanium complexes Dalton transactions (Cambridge, England : 2003)
22590410 2012-05-01 Tri-tert-butyl-phospho-nium hy-droxy-tris-(penta-fluoro-phen-yl)borate Acta crystallographica. Section E, Structure reports online
22455750 2012-04-11 Dispersion energy enforced dimerization of a cyclic disilylated plumbylene Journal of the American Chemical Society
22606190 2012-04-01 2-Vinyl-pyridine-tris-(penta-fluoro-phen-yl)borane hexane monosolvate Acta crystallographica. Section E, Structure reports online
22220839 2012-02-17 Liquid triarylamines: the scope and limitations of Piers-Rubinsztajn conditions for obtaining triarylamine-siloxane hybrid materials The Journal of organic chemistry
21612200 2011-12-19 Mechanistic aspects of bond activation with perfluoroarylboranes Inorganic chemistry
21718018 2011-08-01 Dihydrogen activation by frustrated carbene-borane Lewis pairs: an experimental and theoretical study of carbene variation Inorganic chemistry
21434631 2011-04-20 Extent of M2 δ to ligand π-conjugation in neutral and mixed valence states of bis(4-isonicotinate)-bis(2,4,6-triisopropylbenzoate) dimetal complexes (MM), where M = Mo or W, and their adducts with tris(pentafluorophenyl)boron Journal of the American Chemical Society
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

Related Products

Online Inquiry
  • Verification code
USA
  • International:
  • US & Canada (Toll free):
  • Email:
  • Fax:
UK
  • Email:
Copyright © 2024 BOC Sciences. All rights reserved.
Inquiry Basket