Monosultap

C5H12NNaO6S4CAS 29547-00-0333.38 g/mol

NSSO−OOSSOOOHNa+
Tertiary amine

Properties

Molecular formula
C5H12NNaO6S4
Molar mass
333.38 g/mol
Exact mass
332.9445 Da
logP
-0.39Crippen estimate
Polar surface area
112.0 Ų
H-bond donors / acceptors
2 / 7
Rotatable bonds
7

Hazards

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

Identifiers

CAS number
29547-00-0
SMILES
CN(C)C(CSS([O-])(=O)=O)CSS(=O)(=O)O.[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

8 names
  • Thiosulfuric acid (H2S2O3), SS,SS′-[2-(dimethylamino)-1,3-propanediyl] ester, sodium salt (1:1)
  • Thiosulfuric acid, S,S′-[2-(dimethylamino)trimethylene] ester, monosodium salt
  • Thiosulfuric acid (H2S2O3), S,S′-[2-(dimethylamino)-1,3-propanediyl] ester, monosodium salt
  • 1,3-Propanedithiol, 2-(dimethylamino)-, bis(hydrogen sulfate) (ester) monosodium salt
  • Sha chong dan
  • SCD
  • Monomehypo
  • Shachongdan

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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.

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue.

Elsewhere