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Tri-p-tolylsulfonium Hexafluorophosphate - 90%, high purity , CAS No.146062-15-9

COA

Grade & Purity:

≥90%

Cas Number: 146062-15-9
Molecular Weight: 450.42
MDL number: MFCD06797187
PubChem CID: 13750251

In stock

Item Number

T161790

Grouped product items
SKU	Size	Availability	Price
T161790-200mg	200mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$36.90
T161790-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$41.90
T161790-1g	1g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$126.90
T161790-5g	5g	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$568.90

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Element classified compounds (2014) Phosphorus compounds (460)

Basic Description

Synonyms	hexafluorophosphate(1-); tris(4-methylphenyl)sulfanium \| T2041 \| AKOS015833802 \| Tris(4-methylphenyl)sulfanium hexafluorophosphate \| Tri-p-tolylsulfonium Hexafluorophosphate, >/=90% \| Tri-p-tolylsulfonium Hexafluorophosphate \| Sulfonium,tris(4-methylpheny
Specifications & Purity	≥90%
Shipped In	Normal

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Benzenoids
  - Class Benzene and substituted derivatives
    - Subclass Toluenes

Kingdom	Organic compounds
Superclass	Benzenoids
Class	Benzene and substituted derivatives
Subclass	Toluenes
Intermediate Tree Nodes	Not available
Direct Parent	Toluenes
Alternative Parents	Organosulfur compounds Organic salts Hydrocarbon derivatives Organic cations
Molecular Framework	Aromatic homomonocyclic compounds
Substituents	Toluene - Hydrocarbon derivative - Organic salt - Organosulfur compound - Organic cation - Aromatic homomonocyclic compound
Description	This compound belongs to the class of organic compounds known as toluenes. These are compounds containing a benzene ring which bears a methane group.
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	tris(4-methylphenyl)sulfanium;hexafluorophosphate
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)9-15-21;1-7(2,3,4,5)6/h4-15H,1-3H3;/q+1;-1
InChIKey	BIWXKHOYLGAZDG-UHFFFAOYSA-N
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
Isomeric 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
PubChem CID	13750251
Molecular Weight	450.42
Reaxy-Rn	5899058

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

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1 results found

Lot Number	Certificate Type	Date	Item
H2409184	Certificate of Analysis	Apr 16, 2024	T161790

Chemical and Physical Properties

Solubility	Solubility in water: Practically insoluble; Soluble in Ethanol,Methanol
Melt Point(°C)	171 °C
Molecular Weight	450.400 g/mol
XLogP3
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	7
Rotatable Bond Count	3
Exact Mass	450.101 Da
Monoisotopic Mass	450.101 Da
Topological Polar Surface Area	1.000 Å²
Heavy Atom Count	29
Formal Charge	0
Complexity	325.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	2

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