8-Amino-1-naphthol-5,7-disulfonic acid monosodium salt

C10H8NNaO7S2CAS 52789-62-5341.28 g/mol

Open in Covalent MOL file
NH2SO−OOSOOHOOHNa+
PhenolPrimary amineSulfonic acid

Properties

Molecular formula
C10H8NNaO7S2
Molar mass
341.28 g/mol
Exact mass
340.9640 Da
logP
0.24Crippen estimate
Polar surface area
155.0 Ų
H-bond donors / acceptors
4 / 6
Rotatable bonds
2

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
52789-62-5
SMILES
Nc1c(S([O-])(=O)=O)cc(S(=O)(=O)O)c2cccc(O)c12.[Na+]
InChI

The InChI we hold for this record describes the parent acid and the metal separately rather than the salt above, so it is not shown here.

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Names and synonyms

2 names
  • 1,3-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-, sodium salt (1:1)
  • 1,3-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-, monosodium salt

Work with 8-Amino-1-naphthol-5,7-disulfonic acid monosodium 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

S Acid83-64-753 % similar 1-Amino-2-naphthol-4-sulfonic acid116-63-252 % similar Sodium 5-hydroxy-1-naphthalenesulfonate5419-77-251 % similar Pyranine6358-69-650 % similar 2-Amino-1,5-naphthalenedisulfonic acid sodium salt19532-03-748 % similar Sodium O-phenolsulfonate1300-51-246 % similar Sodium 1-naphthol-4-sulfonate6099-57-645 % similar L Acid117-59-945 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Amino-5-hydroxy-2,7-naphthalenedisulfonic acid monosodium salt5460-09-3

Elsewhere

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