Diphenyliodonium nitrate

C12H10INO3CAS 722-56-5343.12 g/mol

Open in Covalent MOL file
ON+O−O−I+
Aryl halideNitro

Properties

Molecular formula
C12H10INO3
Molar mass
343.12 g/mol
Exact mass
342.9705 Da
logP
-0.42Crippen estimate
Polar surface area
66.2 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
2

Hazards

Danger
Oxidizer (GHS03)

Aggregated from 89 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P210, P220, P280, P370+P378, P501

Identifiers

CAS number
722-56-5
SMILES
O=[N+]([O-])[O-].c1ccc([I+]c2ccccc2)cc1
InChIKey
CQZCVYWWRJDZBO-UHFFFAOYSA-N
InChI
InChI=1S/C12H10I.NO3/c1-3-7-11(8-4-1)13-12-9-5-2-6-10-12;2-1(3)4/h1-10H;/q+1;-1

Weigh it out

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

Names and synonyms

3 names
  • Iodonium, diphenyl-, nitrate (1:1)
  • Iodonium, diphenyl-, nitrate
  • NSC 90597

Work with Diphenyliodonium nitrate

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 bromide1483-73-4Salt Diphenyliodonium iodide2217-79-0Salt

Similar compounds

Nitrate14797-55-843 % similar Lucigenin2315-97-140 % similar Phenylmercuric nitrate55-68-540 % similar Nitrobenzene98-95-339 % similar Barium nitrate10022-31-838 % similar Strontium nitrate10042-76-938 % similar Mercury(II) nitrate10045-94-038 % similar Lanthanum(III) nitrate10099-59-938 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook