Bis(4-tert-butylphenyl)iodonium perfluoro-1-butanesulfonate

Product Information

Molecular Formula:
[(CH3)3CC6H4]2IC4F9SO3
Molecular Weight:
692.42
Description
Cationic photoinitiator. Photoacid generator.
Synonyms
bis(4-tert-butylphenyl)iodanium; 1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate; Bis(4-tert-butylphenyl)iodanium nonafluorobutane-1-sulfonate; Di(4-tert-butylphenyl)iodonium perfluorobutanesulfonate; Bis(4-tert-butylphenyl)iodonium perfluoro-1-butanesulfonate electronic grade; Bis(4-tert-butylphenyl)iodonium perfluoro-1-butanesulfonate, electronic grade, >=99%
IUPAC Name
bis(4-tert-butylphenyl)iodanium1,1,2,2,3,3,4,4,4-nonafluorobutane-1-sulfonate
Canonical SMILES
[O-]S(=O)(=O)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F.CC(C)(C)c1ccc([I+]c2ccc(cc2)C(C)(C)C)cc1
InChI
InChI=1S/C20H26I.C4HF9O3S/c1-19(2,3)15-7-11-17(12-8-15)21-18-13-9-16(10-14-18)20(4,5)65-1(6,3(9,10)11)2(7,8)4(12,13)17(14,15)16/h7-14H,1-6H3(H,14,15,16)/q+1/p-1
InChI Key
DJBAOXYQCAKLPH-UHFFFAOYSA-M
Melting Point
175-177 °C (lit.)
Purity
≥99%
Application
Cationic photoinitiator.

Safety Information

Hazards
H315 - H319 - H335
Precautionary Statement
P302 + P352 - P305 + P351 + P338
Signal Word
Warning

Computed Properties

Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
12
Rotatable Bond Count
6
Exact Mass
692.05037 g/mol
Monoisotopic Mass
692.05037 g/mol
Topological Polar Surface Area
65.6Ų
Heavy Atom Count
38
Formal Charge
0
Complexity
646
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

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The molarity calculator equation

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

The dilution calculator equation

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

This equation is commonly abbreviated as: C1V1 = C2V2

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