chempirical

Dibutyl sulfoxide

C8H18OSCAS 2168-93-6162.29 g/mol

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SO
Sulfoxide

Properties

Molecular formula
C8H18OS
Molar mass
162.29 g/mol
Exact mass
162.1078 Da
Density
0.9223 g/mL (at 40 °C)
Melting point
32.6 °C
Boiling point
106–107 °C (at 2 Torr)
logP
2.34Crippen estimate
Polar surface area
17.1 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
6

Identifiers

CAS number
2168-93-6
SMILES
CCCCS(=O)CCCC
InChIKey
LOWMYOWHQMKBTM-UHFFFAOYSA-N
InChI
InChI=1S/C8H18OS/c1-3-5-7-10(9)8-6-4-2/h3-8H2,1-2H3

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

Names and synonyms

7 names
  • Butane, 1-(butylsulfinyl)-
  • Butyl sulfoxide
  • Butane, 1,1′-sulfinylbis-
  • 1-(Butylsulfinyl)butane
  • Di-n-butyl sulfoxide
  • 1,1′-Sulfinylbis[butane]
  • n-Butyl sulfoxide

Work with Dibutyl sulfoxide

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

Elsewhere

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