Sodium 1-Hexadecanesulfonate

Catalog	DGS15015813
CAS	15015-81-3
Structure
Synonyms	Hexadecane-1-sulfonic acid sodium salt
IUPAC Name	sodium;hexadecane-1-sulfonate
Molecular Weight	328.49
Molecular Formula	C16H33NaO3S
InChI	InChI=1S/C16H34O3S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20(17,18)19;/h2-16H2,1H3,(H,17,18,19);/q;+1/p-1
InChI Key	PNGBYKXZVCIZRN-UHFFFAOYSA-M
Melting Point	265 °C
Solubility	Slightly soluble in water
Appearance	White crystalline solid
Complexity	286
EC Number	239-100-6
Exact Mass	328.20481037
Formal Charge	0
Heavy Atom Count	21
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Isomeric SMILES	CCCCCCCCCCCCCCCCS(=O)(=O)[O-].[Na+]
Monoisotopic Mass	328.20481037
Rotatable Bond Count	15
Topological Polar Surface Area	65.6 Ų