Dihexyl sodium sulfosuccinate

Catalog Number	ACM3006153-1
CAS	3006-15-3
Structure
Synonyms	Sodium dihexyl sulfosuccinate
IUPAC Name	Sodium;1,4-dihexoxy-1,4-dioxobutane-2-sulfonate
Molecular Weight	388.5
Molecular Formula	C16H29NaO7S
Canonical SMILES	CCCCCCOC(=O)CC(C(=O)OCCCCCC)S(=O)(=O)[O-].[Na+]
InChI	InChI=1S/C16H30O7S.Na/c1-3-5-7-9-11-22-15(17)13-14(24(19,20)21)16(18)23-12-10-8-6-4-2;/h14H,3-13H2,1-2H3,(H,19,20,21);/q;+1/p-1
InChI Key	WVFDILODTFJAPA-UHFFFAOYSA-M
Melting Point	230 °C
Purity	80% in H₂O
Appearance	Liquid
Storage	Store at +15 °C to +25 °C
Exact Mass	388.15316872
Hydrogen-Bond Acceptor Count	7
Hydrogen-Bond Donor Count	0
Monoisotopic Mass	388.15316872
Rotatable-Bond Count	16
Topological Polar Surface Area	118 Ų

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