(4-Methylphenyl)[4-(2-methylpropyl)phenyl]iodonium hexafluorophosphate

C₁₇H₂₀F₆IPCAS 344562-80-7496.22 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₇H₂₀F₆IP
Molar mass: 496.22 g/mol
Exact mass: 496.0252 Da
logP: 4.70Crippen estimate
Polar surface area: 0.0 Å²
H-bond donors / acceptors: 0 / 0
Rotatable bonds: 4

Identifiers

CAS number

344562-80-7

SMILES

Cc1ccc([I+]c2ccc(CC(C)C)cc2)cc1.F[P-](F)(F)(F)(F)F

InChIKey

YNDYCGZWQZEBCS-UHFFFAOYSA-N

InChI

InChI=1S/C17H20I.F6P/c1-13(2)12-15-6-10-17(11-7-15)18-16-8-4-14(3)5-9-16;1-7(2,3,4,5)6/h4-11,13H,12H2,1-3H3;/q+1;-1

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Names and synonyms

9 names

Iodonium, (4-methylphenyl)[4-(2-methylpropyl)phenyl]-, hexafluorophosphate(1-) (1:1)
I 250
Photoinitiator 250
Omnirad 250
Iodonium, (4-methylphenyl)[4-(2-methylpropyl)phenyl]-, hexafluorophosphate(1-)
4-Isobutylphenyl-p-tolyliodonium hexafluorophosphate
Irgacure 250
CGI 552
Darocur 250

Work with (4-Methylphenyl)[4-(2-methylpropyl)phenyl]iodonium 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

Similar compounds

4,4′-Dimethyldiphenyliodonium hexafluorophosphate60565-88-066 % similar Bis(4-tert-butylphenyl)iodonium hexafluorophosphate61358-25-640 % similar 1-Bromo-4-(2-methylpropyl)benzene2051-99-239 % similar Isobutylbenzene538-93-239 % similar Diphenyliodonium hexafluorophosphate58109-40-339 % similar 4-Isobutylbenzaldehyde40150-98-937 % similar 1,2-Bis(4-methylphenyl)ethane538-39-635 % similar 4′-Isobutylacetophenone38861-78-835 % similar

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

Elsewhere

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