1-Dodecylpyridinium Chloride - ≥98%(HPLC) , CAS No.104-74-5

CAS: 104-74-5 Cat. No.: D137966 Molecular Weight: 283.88 EC Number: 203-232-2

GRADE & PURITY ≥98%(HPLC)

Synonyms

1-dodecylpyridin-1-ium chloride | C 2 (VAN) | H11279 | 1-dodecylpyridin-1-ium;chloride | DPC (onium compound) | Dehyquart C | N-Laurylpyridinium chloride | DODECYLPYRIDINIUM CHLORIDE | UNII-KJM5A6A3YL | J-001239 | 1-Dodecylpyridinium chloride, AldrichCPR

Storage

Protected from light,Room temperature

Shipped In

Normal

Overview

Dodecylpyridinium chloride is a cationic surfactant.
A long chained pyridine compound.

Application：

Micellization characteristics of dodecylpyridinium chloride have been studied. Properties such as molar conductivity, surface tension and surface adsorption parameters has been reported. A non-ionic-cationic mixed system composed of Triton X-100™ and dodecylpyridinium chloride respectively was studied for its clouding behavior.

Specifications

Synonyms

1-dodecylpyridin-1-ium chloride | C 2 (VAN) | H11279 | 1-dodecylpyridin-1-ium;chloride | DPC (onium compound) | Dehyquart C | N-Laurylpyridinium chloride | DODECYLPYRIDINIUM CHLORIDE | UNII-KJM5A6A3YL | J-001239 | 1-Dodecylpyridinium chloride, AldrichCPR

Specifications & Purity

≥98%(HPLC)

Storage

Protected from light, Room temperature

Shipped In

Normal

Purity

≥98%(HPLC)

Names and Identifiers

• Pubchem Sid: 488180538
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/488180538
• Canonical Smiles: CCCCCCCCCCCC[N+]1=CC=CC=C1.[Cl-]
• IUPAC Name: 1-dodecylpyridin-1-ium;chloride
• InChIKey: GKQHIYSTBXDYNQ-UHFFFAOYSA-M
• INCHI: 1S/C17H30N.ClH/c1-2-3-4-5-6-7-8-9-10-12-15-18-16-13-11-14-17-18;/h11,13-14,16-17H,2-10,12,15H2,1H3;1H/q+1;/p-1
• Isomeric SMILES: CCCCCCCCCCCC[N+]1=CC=CC=C1.[Cl-]
• RTECS: UU4017070
• Alternate CAS: 15416-74-7
• Molecular Weight: 283.88
• Reaxy-Rn: 3762406
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=3762406&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Pyridines and derivatives
      • Subclass Pyridinium derivatives

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Pyridines and derivatives
• Subclass: Pyridinium derivatives
• Intermediate Tree Nodes: Not available
• Direct Parent: Pyridinium derivatives
• Alternative Parents: Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Organic chloride salts Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Pyridinium - Heteroaromatic compound - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organic chloride salt - Organic salt - Organonitrogen compound - Aromatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as pyridinium derivatives. These are compounds containing a pyridinium ring, which is the cationic form of pyridine.
• External Descriptors: Not available

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

Chemical and Physical Properties

• Solubility: Soluble in water (600 g/L) at 20 °C, alcohol, and acetone.
• Sensitivity: Light sensitive；Moisture sensitive
• Molecular Weight: 283.900 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 11
• Exact Mass: 283.207 Da
• Monoisotopic Mass: 283.207 Da
• Topological Polar Surface Area: 3.900 Ų
• Heavy Atom Count: 19
• Formal Charge: 0
• Complexity: 161.000
• 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: 2

XLogP3

References

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5. Puyou Jia, Minrui Zheng, Yufeng Ma, Guodong Feng, Haoyu Xia, Lihong Hu, Meng Zhang, Yonghong Zhou.  (2018)  Clean synthesis of epoxy plasticizer with quaternary ammonium phosphotungstate as catalyst from a byproduct of cashew nut processing.  Journal of Cleaner Production,      [PMID:] [10.1016/j.jclepro.2018.09.238]