Triethylene glycol ditosylate

C20H26O8S2CAS 19249-03-7458.54 g/mol

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EtherSulfonate ester

Properties

Molecular formula
C20H26O8S2
Molar mass
458.54 g/mol
Exact mass
458.1069 Da
Melting point
80–81 °C
logP
2.45Crippen estimate
Polar surface area
105.2 Ų
H-bond donors / acceptors
0 / 8
Rotatable bonds
13

Identifiers

CAS number
19249-03-7
SMILES
Cc1ccc(S(=O)(=O)OCCOCCOCCOS(=O)(=O)c2ccc(C)cc2)cc1
InChIKey
KCONMNWPRXAWKK-UHFFFAOYSA-N
InChI
InChI=1S/C20H26O8S2/c1-17-3-7-19(8-4-17)29(21,22)27-15-13-25-11-12-26-14-16-28-30(23,24)20-9-5-18(2)6-10-20/h3-10H,11-16H2,1-2H3

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Names and synonyms

17 names · show all
  • Ethanol, 2,2′-[1,2-ethanediylbis(oxy)]bis-, 1,1′-bis(4-methylbenzenesulfonate)
  • Triethylene glycol, di-p-toluenesulfonate
  • Ethanol, 2,2′-[1,2-ethanediylbis(oxy)]bis-, bis(4-methylbenzenesulfonate)
  • Triethylene glycol di-4-toluenesulfonate
  • Triethylene glycol ditoluenesulfonate
  • 3,6-Dioxaoctane-1,8-diol ditosylate
  • Triethylene glycol bis(4-toluenesulfonate)
  • 1,8-Bis(p-tolylsulfonyloxy)-3,6-dioxaoctane
  • Triethylene glycol bis(p-toluenesulfonate)
  • Triethyleneglycol bis(toluenesulfonate)
  • 1,8-Bis(tosyloxy)-3,6-dioxaoctane
  • Triethylene glycol di-p-tosylate
  • Triethylene glycol bis(p-tosylate)
  • NSC 244980
  • 2-[2-[2-[[(4-Methylphenyl)sulfonyl]oxy]ethoxy]ethoxy]ethyl 4-methylbenzenesulfonate
  • 1,2-Ethanediylbis(oxy-2,1-ethanediyl) bis(4-methylbenzenesulfonate)
  • (3,6-Dioxaoctane-1,8-diyl)bis(4-methyl-benzenesulfonate)

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Similar compounds

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

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