chempirical

2,2′-Dithiobis[thiophene]

C8H6S4CAS 6911-51-9230.38 g/mol

Open in Covalent MOL file
SSSS
Disulfide

Properties

Molecular formula
C8H6S4
Molar mass
230.38 g/mol
Exact mass
229.9352 Da
Melting point
56 °C
Boiling point
115–145 °C (at 0.02 Torr)
logP
4.61Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
3

Identifiers

CAS number
6911-51-9
SMILES
c1csc(SSc2cccs2)c1
InChIKey
YOLFWWMPGNMXFI-UHFFFAOYSA-N
InChI
InChI=1S/C8H6S4/c1-3-7(9-5-1)11-12-8-4-2-6-10-8/h1-6H

Weigh it out

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

Names and synonyms

10 names
  • Thiophene, 2,2′-dithiobis-
  • Thiophene, 2,2′-dithiodi-
  • α,α′-Dithienyl disulfide
  • 2,2′-Bis(thienyl) disulfide
  • Di-2-thienyl disulfide
  • Bis(2-thienyl) disulfide
  • 1,2-Di(thien-2-yl)disulfane
  • 2,2′-Dithiodithiophene
  • 2-(Thiophen-2-yldisulfanyl)thiophene
  • 2-Thienyl disulfide

Work with 2,2′-Dithiobis[thiophene]

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

2-(Phenylthio)thiophene16718-12-054 % similar 2,2'-Bithiophene492-97-745 % similar Tris(2-thienyl)phosphine24171-89-939 % similar 2-Methylthiophene554-14-339 % similar 2-Chlorothiophene96-43-539 % similar Terthiophene1081-34-138 % similar 2-Phenylthiophene825-55-836 % similar 2-Methoxythiophene16839-97-735 % similar

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

Elsewhere

PubChem CAS Common Chemistry NIST WebBook