Sodium 1-dodecanesulfonate

Catalog Number	ACM2386530-2
CAS	2386-53-0
Structure
Synonyms	1-Dodecanesulfonic acid sodium salt
IUPAC Name	Sodium;dodecane-1-sulfonate
Molecular Weight	272.38
Molecular Formula	C12H25NaO3S
Canonical SMILES	CCCCCCCCCCCCS(=O)(=O)[O-].[Na+]
InChI	InChI=1S/C12H26O3S.Na/c1-2-3-4-5-6-7-8-9-10-11-12-16(13,14)15;/h2-12H2,1H3,(H,13,14,15);/q;+1/p-1
InChI Key	DAJSVUQLFFJUSX-UHFFFAOYSA-M
Melting Point	>300 °C
Purity	98%+
Complexity	235
Covalently-Bonded Unit Count	2
Defined Atom Stereocenter Count	0
Exact Mass	272.14221011
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
Monoisotopic Mass	272.14221011
Physical State	Powder
Rotatable Bond Count	11
Topological Polar Surface Area	65.6 Ų

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Sodium 1-dodecanesulfonate (2386-53-0)

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