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Home > Fluorides > 164594-13-2
164594-13-2 | Iodonium, phenyl[2-(trimethylsilyl)phenyl]-, 1,1,1-trifluoromethanesulfonate (1:1)
CAS No: 164594-13-2 Catalog No: AG001UYT MDL No:
Product Description
Catalog Number:
AG001UYT
Chemical Name:
Iodonium, phenyl[2-(trimethylsilyl)phenyl]-, 1,1,1-trifluoromethanesulfonate (1:1)
CAS Number:
164594-13-2
Molecular Formula:
C16H18F3IO3SSi
Molecular Weight:
502.3625
IUPAC Name:
phenyl-(2-trimethylsilylphenyl)iodanium;trifluoromethanesulfonate
InChI:
InChI=1S/C15H18ISi.CHF3O3S/c1-17(2,3)15-12-8-7-11-14(15)16-13-9-5-4-6-10-13;2-1(3,4)8(5,6)7/h4-12H,1-3H3;(H,5,6,7)/q+1;/p-1
InChI Key:
GSCTXOAWWNOUFK-UHFFFAOYSA-M
SMILES:
[O-]S(=O)(=O)C(F)(F)F.C[Si](c1ccccc1[I+]c1ccccc1)(C)C
Properties
Complexity:
372
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
501.974g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
502.362g/mol
Monoisotopic Mass:
501.974g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
65.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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