Chem
J-GLOBAL ID：200907002279329620   Nikkaji number：J423.195C

Docusate

ドクサート
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C20H37O6[O-]S
Molecular formula furigana： C20-H37-O7-S
Molecular weight： 421.570
InChI： InChI=1S/C20H38O7S/c1-5-9-11-16(7-3)14-26-19(21)13-18(28(23,24)25)20(22)27-15-17(8-4)12-10-6-2/h16-18H,5-15H2,1-4H3,(H,23,24,25)/p-1
InChI key： HNSDLXPSAYFUHK-UHFFFAOYSA-M
SMILES： CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-]
Systematic name  (17)：
  • スルホナトこはく酸ジ(2-エチルヘキシル)
  • 1,4-ジオキソ-1,4-ビス(2-エチルヘキシルオキシ)ブタン-2-スルホナート
  • 2-スルホナトこはく酸ビス(2-エチルヘキシル)
  • スルホナトこはく酸ビス(2-エチルヘキシル)
  • 1,4-ビス(2-エチルヘキシルオキシ)-1,4-ジオキソブタン-2-スルホン酸アニオン
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Other name (17)：
  • Sulfonatosuccinic acid di(2-ethylhexyl) ester
  • 1,4-Dioxo-1,4-bis(2-ethylhexyloxy)butane-2-sulfonate
  • 2-Sulfonatosuccinic acid bis(2-ethylhexyl) ester
  • Sulfonatosuccinic acid bis(2-ethylhexyl) ester
  • 1,4-Bis(2-ethylhexyloxy)-1,4-dioxobutane-2-sulfonic acidanion
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