Disodium (9Z)-1-butoxy-12-oxido-1-oxo-9-octadecen-2-yl sulfate
[CAS# 71873-02-4]

Identification

• Name: Disodium (9Z)-1-butoxy-12-oxido-1-oxo-9-octadecen-2-yl sulfate
• Synonyms: disodium 1-butyl (R)-12-oxido(sulphonatooxy)oleate
• Molecular Formula: C₂₂H₄₀Na₂O₇S
• Molecular Weight: 494.59
• CAS Registry Number: 71873-02-4
• EINECS: 276-112-0
• SMILES: [Na+].[Na+].[O-]C(CCCCCC)C/C=C\CCCCCCC(OS([O-])(=O)=O)C(=O)OCCCC
• InChI: 1S/C22H41O7S.2Na/c1-3-5-7-13-16-20(23)17-14-11-9-8-10-12-15-18-21(29-30(25,26)27)22(24)28-19-6-4-2;;/h11,14,20-21H,3-10,12-13,15-19H2,1-2H3,(H,25,26,27);;/q-1;2*+1/p-1/b14-11-
• InChIKey: IGASDQHQBVJXAF-LVDFRVDWSA-M