chempirical

Ethane-1,2-dithiol

C2H6S2CAS 540-63-694.19 g/mol

Open in Covalent MOL file
HSSH
Thiol

Properties

Molecular formula
C2H6S2
Molar mass
94.19 g/mol
Exact mass
93.9911 Da
Density
1.123 g/mL (at 23.5 °C)
Melting point
−41.2 °C
Boiling point
146 °C
logP
0.85Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1

Identifiers

CAS number
540-63-6
SMILES
SCCS
InChIKey
VYMPLPIFKRHAAC-UHFFFAOYSA-N
InChI
InChI=1S/C2H6S2/c3-1-2-4/h3-4H,1-2H2

Weigh it out

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

Names and synonyms

17 names · show all
  • 1,2-Ethanedithiol
  • Dithioethylene glycol
  • Ethylene dimercaptan
  • s-Ethylene dimercaptan
  • Ethylene glycol, dithio-
  • a-Ethylene dimercaptan
  • Dithioglycol
  • 1,2-Dimercaptoethane
  • Ethylenedithiol
  • Ethylene dithioglycol
  • 1,2-Ethylenedithiol
  • 2-Mercaptoethanethiol
  • NSC 60481
  • 1,2-Dithiolethane
  • EDT
  • 1,2-Dithioethane
  • Ethan-1,2-dithiol

Reactions

Work with Ethane-1,2-dithiol

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 Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Propane-1,3-dithiol109-80-856 % similar 1,4-Butanedithiol1191-08-856 % similar 1,6-Hexanedithiol1191-43-150 % similar 1,8-Octanedithiol1191-62-450 % similar 1,10-Decanedithiol1191-67-950 % similar 1,9-Nonanedithiol3489-28-950 % similar 1,5-Pentanedithiol928-98-350 % similar Propanethiol107-03-942 % similar

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

Same formula

Dimethyl disulfide624-92-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook Wikipedia