chempirical

Divinyl sulfone

C4H6O2SCAS 77-77-0118.15 g/mol

Open in Covalent MOL file
SOO
AlkeneSulfone

Properties

Molecular formula
C4H6O2S
Molar mass
118.15 g/mol
Exact mass
118.0089 Da
Density
1.177 g/mL (at 25 °C)
Melting point
−26 °C
Boiling point
234.5 °C
logP
0.69Crippen estimate
Polar surface area
34.1 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Identifiers

CAS number
77-77-0
SMILES
C=CS(=O)(=O)C=C
InChIKey
AFOSIXZFDONLBT-UHFFFAOYSA-N
InChI
InChI=1S/C4H6O2S/c1-3-7(5,6)4-2/h3-4H,1-2H2

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

Names and synonyms

11 names
  • Ethene, 1,1′-sulfonylbis-
  • Vinyl sulfone
  • 1,1′-Sulfonylbis[ethene]
  • Bis(ethenyl)sulfone
  • NSC 133793
  • NSC 18590
  • NSC 57304
  • Ethenylsulfonylethene
  • 1-Vinylsulfonylethylene
  • Vinylsulfonylethene
  • (Ethenesulfonyl)ethene

Work with Divinyl sulfone

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

1,1′-[Methylenebis(sulfonyl)]bis[ethene]3278-22-642 % similar Methyl vinyl sulfone3680-02-242 % similar (Ethylsulfonyl)ethene1889-59-436 % similar Sodium vinylsulfonate3039-83-636 % similar Phenyl vinyl sulfone5535-48-832 % similar 1,3-Bis(ethenylsulfonyl)-2-propanol67006-32-032 % similar

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

Same formula

Sulfolene77-79-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook