chempirical

Tetrathiafulvalene

C6H4S4CAS 31366-25-3204.34 g/mol

Open in Covalent MOL file
SSSS
AlkeneSulfide

Properties

Molecular formula
C6H4S4
Molar mass
204.34 g/mol
Exact mass
203.9196 Da
Melting point
119.1 °C
Boiling point
90 °C (at 1 Torr)
logP
4.02Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
0

Hazards

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

Identifiers

CAS number
31366-25-3
SMILES
C1=CSC(=C2SC=CS2)S1
InChIKey
FHCPAXDKURNIOZ-UHFFFAOYSA-N
InChI
InChI=1S/C6H4S4/c1-2-8-5(7-1)6-9-3-4-10-6/h1-4H

Weigh it out

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

Names and synonyms

7 names
  • 1,3-Dithiole, 2-(1,3-dithiol-2-ylidene)-
  • δ2,2′-Bi-1,3-dithiole
  • 2-(1,3-Dithiol-2-ylidene)-1,3-dithiole
  • 1,4,5,8-Tetrathiafulvalene
  • TTF
  • NSC 222862
  • 2-(2H-1,3-Dithiol-2-ylidene)-2H-1,3-dithiole

Work with Tetrathiafulvalene

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

Malotilate59937-28-931 % similar

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

Elsewhere

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