1H-1,2,3-Triazole-4-thiol sodium salt

C2H2N3NaSCAS 59032-27-8123.11 g/mol

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HSNNN−Na+
Thiol

Properties

Molecular formula
C2H2N3NaS
Molar mass
123.11 g/mol
Exact mass
122.9867 Da
logP
-0.29Crippen estimate
Polar surface area
41.6 Ų
H-bond donors / acceptors
2 / 3
Rotatable bonds
0

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
59032-27-8
SMILES
Sc1cnn[n-]1.[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

6 names
  • 1H-1,2,3-Triazole-5-thiol, sodium salt (1:1)
  • 1H-1,2,3-Triazole-4-thiol, monosodium salt
  • 5-Mercapto-1H-1,2,3-triazole sodium salt
  • 4-Mercapto-1,2,3-triazole sodium salt
  • Sodium 1H-1,2,3-triazole-4-thiolate
  • Sodium 1H-1,2,3-triazol-5-ylsulfanide

Work with 1H-1,2,3-Triazole-4-thiol 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

Elsewhere

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