2-Sulfo-Butanedioic Acid 1,4-Bis(1-Methylpentyl) Ester Sodium Salt (1:1)
[CAS# 6001-97-4]

Identification

• Name: 2-Sulfo-Butanedioic Acid 1,4-Bis(1-Methylpentyl) Ester Sodium Salt (1:1)
• Synonyms: Sodium 1,4-Bis(1-Methylpentoxy)-1,4-Dioxo-Butane-2-Sulfonate; Sodium 1,4-Bis(1-Methylpentoxy)-1,4-Dioxobutane-2-Sulfonate; Sodium 1,4-Diketo-1,4-Bis(1-Methylpentoxy)Butane-2-Sulfonate
• Molecular Formula: C₁₆H₂₉NaO₇S
• Molecular Weight: 388.45
• CAS Registry Number: 6001-97-4
• EINECS: 227-847-0
• SMILES: C(C([S]([O-])(=O)=O)C(OC(CCCC)C)=O)C(OC(CCCC)C)=O.[Na+]
• InChI: 1S/C16H30O7S.Na/c1-5-7-9-12(3)22-15(17)11-14(24(19,20)21)16(18)23-13(4)10-8-6-2;/h12-14H,5-11H2,1-4H3,(H,19,20,21);/q;+1/p-1
• InChIKey: QJDJVBIQBWDFNZ-UHFFFAOYSA-M