chempirical

Sodium decanesulfonate

C10H21NaO3SCAS 13419-61-9244.32 g/mol

Open in Covalent MOL file
SO−OONa+
Sulfonic acid

Properties

Molecular formula
C10H21NaO3S
Molar mass
244.32 g/mol
Exact mass
244.1109 Da
logP
2.63Crippen estimate
Polar surface area
54.4 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
9

Identifiers

CAS number
13419-61-9
SMILES
CCCCCCCCCCS([O-])(=O)=O.[Na+]
InChIKey
SBNUEVPRRHCPNQ-UHFFFAOYSA-N
InChI
InChI=1S/C10H22O3S.Na/c1-2-3-4-5-6-7-8-9-10-14(11,12)13;/h2-10H2,1H3,(H,11,12,13);

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

6 names
  • 1-Decanesulfonic acid, sodium salt (1:1)
  • 1-Decanesulfonic acid, sodium salt
  • Sodium decylsulfonate
  • Sodium 1-decanesulfonate
  • Sodium n-decylsulfonate
  • Sodium capryl sulfonate

Work with Sodium decanesulfonate

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Sodium hexadecylsulfonate15015-81-3100 % similar Sodium heptanesulfonate22767-50-6100 % similar Sodium dodecylsulfonate2386-53-0100 % similar Sodium hexanesulfonate2832-45-3100 % similar Sodium 1-nonanesulfonate35192-74-6100 % similar Sodium octanesulfonate5324-84-5100 % similar Sodium myristylsulfonate6994-45-2100 % similar Sodium pentanesulfonate22767-49-396 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

PubChem CAS Common Chemistry NIST WebBook