Sulfobetaine 12 - ≥98% , CAS No.14933-08-5

CAS: 14933-08-5 Cat. No.: S105512 Molecular Weight: 335.55 Beilstein Registry Number: 4145308 EC Number: 239-002-3 PubChem CID: 84703

GRADE & PURITY ≥98%

Synonyms

SB3-12 | DTXCID8029078 | dodecyldimethyl(3-sulfopropyl)ammonium hydroxide | NCGC00260353-01 | SY052089 | n-dodecyl-n,n-dimethyl-3-ammonio-1-propanesulphonate | N-DODECYL-N,N-DIMETHYL-3-AMMONIUM-1-PROPANESULFONATE | naftidrofuryl hydrogen oxalate | J-00857

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Overview

N-Dodecyl-N,N-dimethyl-3-ammonio-1-propanesulfonate is a zwitterionic surfactant.

N-Dodecyl-N,N-dimethyl-3-ammonio-1-propanesulfonate has been used in a study to assess protein structural change in a mixed system of ionic and zwitterionic surfactants. It has also been used in a study to investigate the interaction between ionic liquid and zwitterionic surfactant.

Specifications

Synonyms

SB3-12 | DTXCID8029078 | dodecyldimethyl(3-sulfopropyl)ammonium hydroxide | NCGC00260353-01 | SY052089 | n-dodecyl-n, n-dimethyl-3-ammonio-1-propanesulphonate | N-DODECYL-N, N-DIMETHYL-3-AMMONIUM-1-PROPANESULFONATE | naftidrofuryl hydrogen oxalate | J-00857

Specifications & Purity

≥98%

Biochemical and Physiological Mechanisms

Synthetic zwitterionic detergent, which unlike other amphoteric surfactants, retains its zwitterionic character over a broad pH range. This property is attributed to the presence of both a strongly basic quaternary ammonium ion and an acidic sulfonate ion

Storage

Store at 2-8°C, Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Note

Wherever possible, you should prepare and use solutions on the same day. However, if you need to make up stock solutions in advance, we recommend that you store the solution as aliquots in tightly sealed vials at -20°C. Generally, these will be useable for up to one month. Before use, and prior to opening the vial we recommend that you allow your product to equilibrate to room temperature for at least 1 hour. Need more advice on solubility, usage and handling? Please visit our frequently asked questions (FAQ) page for more details.

Purity

≥98%

Names and Identifiers

• Canonical Smiles: CCCCCCCCCCCC[N+](C)(C)CCCS(=O)(=O)[O-]
• IUPAC Name: 3-[dodecyl(dimethyl)azaniumyl]propane-1-sulfonate
• InChIKey: IZWSFJTYBVKZNK-UHFFFAOYSA-N
• 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
• Isomeric SMILES: CCCCCCCCCCCC[N+](C)(C)CCCS(=O)(=O)[O-]
• WGK Germany: 2
• PubChem CID: 84703
• UN Number: 3261
• Molecular Weight: 335.55
• Beilstein: 4145308
• Reaxy-Rn: 4145308

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds
      • Subclass Quaternary ammonium salts

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Quaternary ammonium salts
• Intermediate Tree Nodes: Not available
• Direct Parent: Tetraalkylammonium salts
• Alternative Parents: Organosulfur compounds Organopnictogen compounds Organic zwitterions Organic salts Organic oxides Hydrocarbon derivatives Amines
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tetraalkylammonium salt - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Organic salt - Organic zwitterion - Organosulfur compound - Amine - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as tetraalkylammonium salts. These are organonitrogen compounds containing a quaternary ammonium substituted with four alkyl chains.
• External Descriptors: a small molecule

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Mechanisms of Action

Chemical and Physical Properties

• Solubility: Chloroform (Slightly), Methanol (Slightly)
• Sensitivity: Moisture sensitive
• Flash Point(°F): 110 °C
• Flash Point(°C): 110°C
• Melt Point(°C): 244°C(lit.)
• Molecular Weight: 335.500 g/mol
• XLogP3: 5.000
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 14
• Exact Mass: 335.249 Da
• Monoisotopic Mass: 335.249 Da
• Topological Polar Surface Area: 65.600 Ų
• Heavy Atom Count: 22
• Formal Charge: 0
• Complexity: 334.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

References

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