Registration Dossier
Registration Dossier
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EC number: 209-406-4 | CAS number: 577-11-7
Reference substances
- IUPAC name:
- sodium 1,4-bis[(2-ethylhexyl)oxy]-1,4-dioxobutane-2-sulfonate
Inventory
- EC number:
- 209-406-4
- EC name:
- Docusate sodium
- CAS number:
- 577-11-7
- CAS number:
- 577-11-7
Synonyms
- Names:
- sodium di-(2-ethylhexyl)sulfosuccinate dioctyl sodium sulfosuccinate
- Aerosol OT-B
- Butanedioic acid, sulfo-, 1,4-bis(2-ethylhexyl) ester, sodium salt
- DOSS
- DOSS
- Dioctylsulfosuccinate, Na salt
- dioctyl sodium sulfosuccinate
- sodium di-(2-ethylhexyl)sulfosuccinate
- Identifier:
- IUPAC name
- docusate sodium
- Identifier:
- IUPAC name
- sodium 1,4-bis((2-ethylhexyl)oxy)-1,4-dioxobutane-2-sulfonate
- Identifier:
- IUPAC name
- sodium 1,4-bis(2-ethylhexoxy)-1,4-dioxobutane-2-sulfonate
- Identifier:
- IUPAC name
- sodium 1,4-bis[(2-ethylhexyl)oxy]-1,4-dioxobutane-2-sulfonate
- Identifier:
- other: InChl
- 1S/C20H38O7S.Na/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);/q;+1/p-1
- Identifier:
- other: Molecular formula
- C20H38O7S.Na
- Identifier:
- other: SMILES notation
- CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)O[Na]
- Identifier:
- other: SMILES notation
- CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[Na+]
- Identifier:
- other: InChl
- InChI=1/C20H38O7S.Na/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);/q;+1/p-1
- Identifier:
- other: InChl
- InChI=1S/C20H38O7S.Na/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);/q;+1/p-1
- Identifier:
- other: SMILES notation
- [Na+].CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S([O-])(=O)=O
- Identifier:
- other: SMILES notation
- [Na]OS(=O)(C(CC(OCC(CCCC)CC)=O)C(OCC(CCCC)CC)=O)=O
- sodium 1,4-bis[(2-ethylhexyl)oxy]-1,4-dioxobutane-2-sulfonate
Molecular and structural information
- Molecular formula:
- C20H38O7S.Na
- Molecular weight:
- 444.56
- SMILES notation:
- [Na+].[O-]S(=O)(=O)C(CC(=O)OCC(CC)CCCC)C(=O)OCC(CC)CCCC
- InChl:
- InChI=1/C20H38O7S.Na/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);/q;+1/p-1
- Structural formula:
Related substances
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