Diphenyl[(phenylthio)phenyl]sulfonium hexafluorophosphate

C₂₄H₁₉F₆PS₂CAS 75482-18-7516.50 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₂₄H₁₉F₆PS₂
Molar mass: 516.50 g/mol
Exact mass: 516.0570 Da
logP: 10.32Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 1
Rotatable bonds: 5

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

75482-18-7

SMILES

C1=CC=C(C=C1)SC2=CC=CC=C2[S+](C3=CC=CC=C3)C4=CC=CC=C4.F[P-](F)(F)(F)(F)F

InChIKey

SFWSATMGMAKCIF-UHFFFAOYSA-N

InChI

InChI=1S/C24H19S2.F6P/c1-4-12-20(13-5-1)25-23-18-10-11-19-24(23)26(21-14-6-2-7-15-21)22-16-8-3-9-17-22;1-7(2,3,4,5)6/h1-19H;/q+1;-1

Weigh it out

Type any one amount. The others follow from the molar mass.

Work with Diphenyl[(phenylthio)phenyl]sulfonium hexafluorophosphate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Diphenyl[(phenylthio)phenyl]sulfonium hexafluorophosphate68156-13-8

Similar compounds

Bis[4-(diphenylsulfonio)phenyl] sulfide bis(hexafluorophosphate)74227-35-362 % similar (p-Thiophenoxyphenyl)diphenylsulfonium hexafluoroantimonate71449-78-044 % similar 4,4′-Bis[diphenylsulfonio]phenylsulfide bishexafluoroantimonate89452-37-941 % similar 2-(Phenylthio)aniline1134-94-738 % similar 2-Methyl diphenyl sulfide13963-35-438 % similar Diphenyl sulfide139-66-235 % similar 2-(Phenylthio)aniline hydrochloride6764-13-235 % similar Diphenyliodonium hexafluorophosphate58109-40-333 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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