Diphenyliodonium iodide

C12H10I2CAS 2217-79-0408.02 g/mol

Open in Covalent MOL file
I−I+
Aryl halide

Properties

Molecular formula
C12H10I2
Molar mass
408.02 g/mol
Exact mass
407.8872 Da
Melting point
162 °C
logP
-3.18Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 45 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
2217-79-0
SMILES
[I-].c1ccc([I+]c2ccccc2)cc1
InChIKey
WQIRVUAXANLUPO-UHFFFAOYSA-M
InChI
InChI=1S/C12H10I.HI/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;/h1-10H;1H/q+1;/p-1

Weigh it out

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

Names and synonyms

3 names
  • Iodonium, diphenyl-, iodide (1:1)
  • Iodonium, diphenyl-, iodide
  • NSC 172526

Reactions

Work with Diphenyliodonium iodide

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.

Diphenyliodonium triflate66003-76-7Salt Diphenyliodonium chloride1483-72-3Salt Diphenyliodonium hexafluorophosphate58109-40-3Salt Diphenyliodonium nitrate722-56-5Salt Diphenyliodonium bromide1483-73-4Salt

Similar compounds

Tetraphenylphosphonium iodide2065-67-043 % similar Methyltriphenylarsonium iodide1499-33-838 % similar Methyltriphenylphosphonium iodide2065-66-938 % similar Trimethylphenylammonium iodide98-04-438 % similar Isopropyltriphenylphosphonium iodide24470-78-833 % similar Benzyltrimethylammonium iodide4525-46-633 % similar Ethyltriphenylphosphonium iodide4736-60-133 % similar Biphenyl92-52-433 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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