Tri-p-tolylsulfonium Hexafluorophosphate
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
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.
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].
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
0
Hydrogen Bond Acceptor Count
7
Rotatable Bond Count
3
Exact Mass
450.10057781 g/mol
Monoisotopic Mass
450.10057781 g/mol
Topological Polar Surface Area
1Ų
Heavy Atom Count
29
Formal Charge
0
Complexity
325
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
2
Compound Is Canonicalized
Yes
Patents
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| 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 |
