User:Doc James/Docusate

Doc James/Docusate

Clinical data
ATC code	A06AA02 (WHO)
Identifiers
IUPAC name Sodium 1,4-bis(2-ethylhexoxy)-1,4-dioxobutane-2-sulfonate
CAS Number	577-11-7
PubChem CID	23673837
ChemSpider	10861
UNII	F05Q2T2JA0
Chemical and physical data
Formula	C20H37NaO7S
Molar mass	444.56 g/mol
3D model (JSmol)	Interactive image
Density	1.1 g/cm3 g/cm3
Melting point	153 to 157 °C (307 to 315 °F)
Solubility in water	1 in 70 parts, yes mg/mL (20 °C)
SMILES [Na+].[O-]S(=O)(=O)C(C(=O)OCC(CC)CCCC)CC(=O)OCC(CC)CCCC
InChI 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 Key:APSBXTVYXVQYAB-UHFFFAOYSA-M