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Substance Name: Docusate hydrogen
RN: 10041-19-7
UNII: M7P27195AG
InChIKey: HNSDLXPSAYFUHK-UHFFFAOYSA-N

Note

  • All-purpose surfactant, wetting agent, and solubilizer used in the drug, cosmetics, and food industries. It has also been used in laxatives and as cerumenolytics. It is usually administered as either the calcium, potassium, or sodium salt.

Molecular Formula

  • C20-H38-O7-S

Molecular Weight

  • 422.5792
 

Classification Code

  • Surface-Active Agents
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Names and Synonyms

Name of Substance

  • Dioctyl sulfosuccinic acid
  • Docusate hydrogen

MeSH Heading

  • Dioctyl sulfosuccinic acid

Synonyms

  • 1,4-Bis(2-ethylhexyl) sulfosuccinate
  • 1,4-Bis(2-ethylhexyloxy)-1,4-dioxo-2-butansulfonsaeure
  • 1,4-Bis(2-ethylhexyloxy)-1,4-dioxo-2-butansulfonsaeure [IUPAC]
  • Bis(2-ethylhexyl)succinat-2-sulfonsaeure
  • Di-beta-ethylhexyl sodium sulfo-succinate
  • Dioctyl sulfosuccinic acid
  • Dioctylsulfosuccinsaeure
  • Doc-Q-Lace
  • Docusate
  • EINECS 233-124-0
  • Spolion 8
  • UNII-M7P27195AG

Systematic Names

  • 1,4-Bis(2-ethylhexyl) 2-sulphosuccinate
  • Butanedioic acid, 2-sulfo-, 1,4-bis(2-ethylhexyl) ester
  • Butanedioic acid, sulfo-, 1,4-bis(2-ethylhexyl) ester

Registry Numbers

CAS Registry Number

  • 10041-19-7

FDA UNII

  • M7P27195AG

Other Registry Numbers

  • 123344-03-6
  • 147-89-7
  • 21954-86-9
  • 894411-97-3

Related Registry Numbers

  • 128-49-4 (calcium salt)
  • 19149-47-4 (magnesium salt)
  • 30673-56-4 (ammonium salt)
  • 577-11-7 (hydrochloride salt)

System Generated Number

  • 0010041197

Structure Descriptors

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)

InChIKey

HNSDLXPSAYFUHK-UHFFFAOYSA-N

Smiles

CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O