N-Dodecyl-N,N-dimethyl-3-ammonio-1-propanesulfonate

C17H37NO3SCAS 14933-08-5335.55 g/mol

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Quaternary ammoniumSulfonic acid

Properties

Molecular formula
C17H37NO3S
Molar mass
335.55 g/mol
Exact mass
335.2494 Da
Melting point
300–302 °C (decomposes)
logP
3.92Crippen estimate
Polar surface area
57.2 Ų
H-bond donors / acceptors
0 / 3
Rotatable bonds
15

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless.

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Identifiers

CAS number
14933-08-5
SMILES
CCCCCCCCCCCC[N+](C)(C)CCCS(=O)(=O)[O-]
InChIKey
IZWSFJTYBVKZNK-UHFFFAOYSA-N
InChI
InChI=1S/C17H37NO3S/c1-4-5-6-7-8-9-10-11-12-13-15-18(2,3)16-14-17-22(19,20)21/h4-17H2,1-3H3

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

Names and synonyms

46 names · show all
  • Dodecyldimethyl(3-sulfopropyl)ammonium inner salt
  • Sulfobetaine 3-10
  • 3-(Dodecyldimethylammonio)propanesulfonate
  • Laurylpropylsulfobetaine
  • N-Dodecyl-N,N-dimethyl-3-ammonio-1-propanesulphonate
  • ZW 3-12
  • DPS
  • 3-(N,N-Dimethyl-N-laurylamino)propanesulfonic acid inner salt
  • 3-(N-Lauryl-N,N-dimethylamino)propanesulfonate inner salt
  • Anzergent 3-12
  • N-Dodecyl-N,N-dimethyl-3-ammonium-1-propanesulfonate
  • 3-(Dodecyldimethylammonio)propanesulfonate inner salt
  • 3-(N,N-Dimethyl-1-dodecylammonium)propanesulfonate
  • SB 12
  • SB 12 (onium compound)
  • DSB
  • C 12APS
  • C12APS
  • Dodecyldimethylammonium propanesulfonate
  • 1-Dodecanaminium, N,N-dimethyl-N-(3-sulfopropyl)-, inner salt
  • Ammonium, dodecyldimethyl(3-sulfopropyl)-, hydroxide, inner salt
  • 1-Dodecanaminium, N,N-dimethyl-N-(3-sulfopropyl)-, hydroxide, inner salt
  • 3-(N,N-Dimethyl-N-dodecylammonio)propane-1-sulfonate
  • 3-(Dimethyldodecylammonio)propane-1-sulfonate
  • Zwittergent 3-12
  • N-Dodecylsulfobetaine
  • ZWIG 12
  • ZWT 12
  • 3-(N-Dodecyl-N,N-dimethylammonium)propane-1-sulfonic acid inner salt
  • Zwittergent TM 3-12
  • Zwittergent TM 12
  • SB 3-12
  • SB12
  • Ralufon DL
  • SB12 (quaternary compound)
  • 3-(N-Dodecyl-N,N-dimethylammonio)-1-propanesulfonate
  • Sulfobetaine 12
  • Hartomer HB 5175
  • NDA
  • Dodecyldimethyl(3-sulfopropyl)ammonium hydroxide inner salt
  • 3-(Dodecyldimethylammonio)-1-propanesulfonate
  • α-(Dodecyldimethylammonio)-ω-propanesulfonate
  • Sulfobetain 12
  • Dodecyldimethyl(3-sulfopropyl)ammonium hydroxide
  • N-Dodecyl-N,N-dimethylammonio-3-propanesulfonate
  • DDAPS

Work with N-Dodecyl-N,N-dimethyl-3-ammonio-1-propanesulfonate

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

N-Octadecyl-N,N-dimethyl-3-ammonio-1-propanesulfonate13177-41-8100 % similar Zwittergent 3-1414933-09-6100 % similar Zwittergent 31015163-36-7100 % similar N-Octylsulfobetaine15178-76-4100 % similar N-Hexadecyl-N,N-dimethyl-3-ammonio-1-propanesulfonate2281-11-0100 % similar Sodium decanesulfonate13419-61-961 % similar Sodium hexadecylsulfonate15015-81-361 % similar Sodium heptanesulfonate22767-50-661 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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