chempirical

Ferron

C9H6INO4SCAS 547-91-1351.11 g/mol

Open in Covalent MOL file
OSOOHIOHN
Aryl halidePhenolSulfonic acid

Properties

Molecular formula
C9H6INO4S
Molar mass
351.11 g/mol
Exact mass
350.9062 Da
Melting point
260 °C (decomposes)
logP
1.79Crippen estimate
Polar surface area
87.5 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
1

Identifiers

CAS number
547-91-1
SMILES
O=S(=O)(O)c1cc(I)c(O)c2ncccc12
InChIKey
ZBJWWKFMHOAPNS-UHFFFAOYSA-N
InChI
InChI=1S/C9H6INO4S/c10-6-4-7(16(13,14)15)5-2-1-3-11-8(5)9(6)12/h1-4,12H,(H,13,14,15)

Weigh it out

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

Names and synonyms

16 names · show all
  • Meditrene
  • Quiniophen
  • Yellon
  • 5-Quinolinesulfonic acid, 8-hydroxy-7-iodo-
  • 8-Hydroxy-7-iodo-5-quinolinesulfonic acid
  • Loretin
  • 7-Iodo-8-hydroxylquinoline-5-sulfonic acid
  • Ferron (analytical reagent)
  • 7-Iodo-5-sulfonic acid-8-hydroxyquinoline
  • 7-Iodo-8-hydroxyquinoline-5-sulfonic acid
  • 8-Hydroxy-7-iodoquinoline-5-sulfonic acid
  • 7-Iodo-8-quinolinol-5-sulfonic acid
  • 5-Sulfo-7-iodo-8-hydroxyquinoline
  • 7-Iodooxine-5-sulfonic acid
  • 5-Sulfo-7-iodo-8-quinolinol
  • NSC 3784

Work with Ferron

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

Diiodohydroxyquinoline83-73-863 % similar Clioquinol130-26-757 % similar 8-Hydroxyquinoline-5-sulfonic acid84-88-857 % similar 8-Quinolinesulfonic acid85-48-348 % similar Actinoquinol15301-40-346 % similar 2-Amino-1-naphthol-4-sulfonic acid567-13-545 % similar 2-Nitroso-1-naphthol-4-sulfonic acid3682-32-443 % similar 5,7-Dibromo-8-hydroxyquinoline521-74-441 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook