Tri-p-tolylsulfonium Hexafluorophosphate

Inquiry

Molecular Formula:

C21H21F6PS

Molecular Weight:

450.42

CAS Number:

146062-15-9

Catalog Number:

146062-15-9

Product Information

Molecular Formula:

C21H21F6PS

Molecular Weight:

450.42

Description

Tri-p-tolylsulfonium Hexafluorophosphate is a biomedical reagent extensively employed in the biomedical sector and remarkably encompasses a diverse range of applications pertaining to organic synthesis, particularly in the amalgamation of sundry chemicals and pharmaceutical compounds. Its undeniable potency as a catalyst for multifaceted reactions unfailingly expedites the process of drug synthesis.

Synonyms

Tris(4-methylphenyl)sulfoniumHexafluorophosphate

IUPAC Name

tris(4-methylphenyl)sulfaniumhexafluorophosphate

Canonical SMILES

CC1=CC=C(C=C1)[S+](C2=CC=C(C=C2)C)C3=CC=C(C=C3)C.F[P-](F)(F)(F)(F)F

InChI

InChI=1S/C21H21S.F6P/c1-16-4-10-19(11-5-16)22(20-12-6-17(2)7-13-20)21-14-8-18(3)9-15-211-7(2,3,4,5)6/h4-15H,1-3H3/q+1-1

InChI Key

BIWXKHOYLGAZDG-UHFFFAOYSA-N

Melting Point

171 °C

Purity

>90.0%(LC)

Appearance

White to Almost white powder to crystaline

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].

Computed Properties

Hydrogen Bond Donor Count

Hydrogen Bond Acceptor Count

Rotatable Bond Count

Exact Mass

450.10057781 g/mol

Monoisotopic Mass

450.10057781 g/mol

Topological Polar Surface Area

1Å²

Heavy Atom Count

Formal Charge

Complexity

325

Isotope Atom Count

Defined Atom Stereocenter Count

Undefined Atom Stereocenter Count

Defined Bond Stereocenter Count

Undefined Bond Stereocenter Count

Covalently-Bonded Unit Count

Compound Is Canonicalized

Yes

Patents

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JP-2022040855-A	Photo-alignment film for polymerizable liquid crystal compounds and its manufacturing method	2020-08-31
JP-2020180306-A	Impact-resistant adhesives and aircraft adhesives	2020-08-17
JP-2020180307-A	Adhesives for fixing small areas and adhesives for portable electronic devices	2020-08-17
JP-2022022600-A	Conductive members, their manufacturing methods, and semiconductor devices	2020-06-29
WO-2021261503-A1	Manufacturing method for connection structure	2020-06-23

The molarity calculator equation

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

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The dilution calculator equation

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

This equation is commonly abbreviated as: C₁V₁ = C₂V₂

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