Molecule record

4-methylsulfonyloxybutyl methanesulfonate

C6H14O6S2

246.31 g/mol

Loading structure

Molecular properties

Formula
C6H14O6S2
Molar mass
246.31 g·mol−1
Exact mass
246.0232 Da
0
PubChem CID
2478

Functional groups

Alkane / alkyl carbon

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 1,4-BUTANEDIOL DIMETHANESULFONATE
  • 1,4-Dimesyloxybutane
  • 55-98-1
  • Busulfano
  • Busulfanum
  • Busulfex
  • Busulphan
  • Leucosulfan
Show all 24 synonyms
  • Mablin
  • Mielevcin
  • Mielosan
  • Mielucin
  • Milecitan
  • Mileran
  • Misulban
  • Mitostan
  • Myeleukon
  • Myeloleukon
  • Myelosan
  • Mylecytan
  • Myleran
  • Sulfabutin
  • Sulphabutin
  • busulfan

Structure identifiers

Canonical SMILES
CS(=O)(=O)OCCCCOS(C)(=O)=O
Isomeric SMILES
CS(=O)(=O)OCCCCOS(=O)(=O)C
InChI
InChI=1S/C6H14O6S2/c1-13(7,8)11-5-3-4-6-12-14(2,9)10/h3-6H2,1-2H3
InChIKey
COVZYZSDYWQREU-UHFFFAOYSA-N
PubChem CID
2478

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 4-methylsulfonyloxybutyl methanesulfonate; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 4-methylsulfonyloxybutyl methanesulfonate; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record