chempirical

8-Ethoxy-5-quinolinesulfonic acid sodium salt

C11H10NNaO4SCAS 7246-07-3275.25 g/mol

Open in Covalent MOL file
OSO−OONNa+
EtherSulfonic acid

Properties

Molecular formula
C11H10NNaO4S
Molar mass
275.25 g/mol
Exact mass
275.0228 Da
logP
1.50Crippen estimate
Polar surface area
76.5 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
3

Identifiers

CAS number
7246-07-3
SMILES
CCOc1ccc(S([O-])(=O)=O)c2cccnc12.[Na+]
InChIKey
RCVZWTQZOWXWQX-UHFFFAOYSA-N
InChI
InChI=1S/C11H11NO4S.Na/c1-2-16-9-5-6-10(17(13,14)15)8-4-3-7-12-11(8)9;/h3-7H,2H2,1H3,(H,13,14,15);

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Names and synonyms

11 names
  • 5-Quinolinesulfonic acid, 8-ethoxy-, sodium salt (1:1)
  • 5-Quinolinesulfonic acid, 8-ethoxy-, sodium salt
  • Corodenin
  • Sodium actinoquinol
  • Sodium etoquinol
  • Sodium tequinol
  • Uviban
  • Actinoquinol sodium
  • Sodium 8-ethoxyquinoline-5-sulfonate
  • Actinoquinol sodium salt
  • Etoquinol sodium

Work with 8-Ethoxy-5-quinolinesulfonic acid sodium salt

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

Actinoquinol15301-40-367 % similar Disodium 1,5-naphthalenedisulfonate1655-29-443 % similar Sodium naphthionate130-13-240 % similar Sodium 1-naphthol-4-sulfonate6099-57-640 % similar 3-Ethoxy-2-nitropyridine74037-50-640 % similar Sodium 1-naphthalenesulfonate130-14-340 % similar Direct yellow 122870-32-838 % similar Sodium 5-hydroxy-1-naphthalenesulfonate5419-77-237 % similar

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

Elsewhere

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