Dodecyltrimethylammonium iodide - ≥95% , CAS No.19014-04-1

CAS: 19014-04-1 Cat. No.: D351326 Molecular Weight: 355.34 PubChem CID: 9884975

GRADE & PURITY ≥95%

Synonyms

1-Dodecanaminium, N,N,N-trimethyl-, iodide (1:1) | AKOS015914779 | dodecyl(trimethyl)azanium;iodide | dodecyl trimethyl ammonium iodide | SCHEMBL810797 | DTXSID10432398 | N,N,N-trimethyldodecan-1-aminium iodide | Dodecyltrimethylammoniumiodide | DODECYLTR

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Synonyms

1-Dodecanaminium, N, N, N-trimethyl-, iodide (1:1) | AKOS015914779 | dodecyl(trimethyl)azanium;iodide | dodecyl trimethyl ammonium iodide | SCHEMBL810797 | DTXSID10432398 | N, N, N-trimethyldodecan-1-aminium iodide | Dodecyltrimethylammoniumiodide | DODECYLTR

Specifications & Purity

≥95%

Storage

Argon charged, Room temperature

Shipped In

Normal

Purity

≥95%

Names and Identifiers

• Pubchem Sid: 504765043
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504765043
• Canonical Smiles: CCCCCCCCCCCC[N+](C)(C)C.[I-]
• IUPAC Name: dodecyl(trimethyl)azanium;iodide
• InChIKey: YIFWXQBNRQNUON-UHFFFAOYSA-M
• INCHI: 1S/C15H34N.HI/c1-5-6-7-8-9-10-11-12-13-14-15-16(2,3)4;/h5-15H2,1-4H3;1H/q+1;/p-1
• Isomeric SMILES: CCCCCCCCCCCC[N+](C)(C)C.[I-]
• PubChem CID: 9884975
• Molecular Weight: 355.34

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: Organic iodide salts Hydrocarbon derivatives Amines Organic cations
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tetraalkylammonium salt - Hydrocarbon derivative - Organic iodide salt - Organic salt - Amine - Organic cation - 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: 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

• Sensitivity: Moisture sensitive;light sensitive
• Molecular Weight: 355.340 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 11
• Exact Mass: 355.174 Da
• Monoisotopic Mass: 355.174 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 135.000
• 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

1. Siyu Li, Feng Liu, Dayang Wang, Keke Huang, Wensheng Yang, Renguo Xie.  (2025)  Precise Control of Halogen Distribution in Monolayer Hybrid Perovskites through Mechanochemistry.  Journal of Physical Chemistry C,      [PMID:] [10.1021/acs.jpcc.4c08389]

2. Yabin Ma, Chao Luo, Changling Zhan, Keli Wang, Jiandong He, Peng Gao, Zhuye Bi, Yingzhuang Ma, Qing Zhao.  (2025)  Crystallization-activated moisture barrier for high-tolerance manufacturing of perovskite solar cells.  Science Advances,  11  (43):   [PMID:41134895] [10.1126/sciadv.ady5703]