Triethylmethylammonium bromide - ≥99% , CAS No.2700-16-5

CAS: 2700-16-5 Cat. No.: T169178 Molecular Weight: 196.13 EC Number: 220-282-0 PubChem CID: 3083778

GRADE & PURITY ≥99%

Synonyms

AMY13795 | FT-0628342 | triethyl(methyl)azanium;bromide | N,N-Diethyl-N-methylethanaminiumbromide | Triethylmethylammonium bromide | Methyltriethylammonium bromide | DTXSID50949778 | AKOS016010359 | AS-78191 | triethyl(methyl)ammonium;bromide | EINECS 220

Storage

Room temperature,Argon charged

Shipped In

Normal

Specifications

Synonyms

AMY13795 | FT-0628342 | triethyl(methyl)azanium;bromide | N, N-Diethyl-N-methylethanaminiumbromide | Triethylmethylammonium bromide | Methyltriethylammonium bromide | DTXSID50949778 | AKOS016010359 | AS-78191 | triethyl(methyl)ammonium;bromide | EINECS 220

Specifications & Purity

≥99%

Storage

Room temperature, Argon charged

Shipped In

Normal

Purity

≥99%

Names and Identifiers

• Pubchem Sid: 504762411
• Pubchem Sid Url: https://pubchem.ncbi.nlm.nih.gov/substance/504762411
• Canonical Smiles: CC[N+](C)(CC)CC.[Br-]
• IUPAC Name: triethyl(methyl)azanium;bromide
• InChIKey: GRVPDGGTLNKOBZ-UHFFFAOYSA-M
• INCHI: 1S/C7H18N.BrH/c1-5-8(4,6-2)7-3;/h5-7H2,1-4H3;1H/q+1;/p-1
• Isomeric SMILES: CC[N+](C)(CC)CC.[Br-]
• PubChem CID: 3083778
• Molecular Weight: 196.13

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 bromide salts Hydrocarbon derivatives Amines Organic cations
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tetraalkylammonium salt - Hydrocarbon derivative - Organic bromide 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: Hygroscopic
• Molecular Weight: 196.130 g/mol
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 195.062 Da
• Monoisotopic Mass: 195.062 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 47.100
• 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. Wanwan Wang, Zhiqiang Fang, Ming Zhao, Yan Peng, Jiujun Zhang, Shiyou Guan.  (2020)  Solid polymer electrolytes based on the composite of PEO–LiFSI and organic ionic plastic crystal.  CHEMICAL PHYSICS LETTERS,      [PMID:] [10.1016/j.cplett.2020.137335]

2. Zhi-Jie Wang, Ming-Jing Shen, Zhi-Peng Rao, Pei-Zhi Huang, Meng-Meng Lun, Bo-Wen Deng, Jun-Yi Li, Chang-Feng Wang, Hai-Feng Lu, Da-Wei Fu, Yi Zhang.  (2024)  Structural phase transition drives outright photoluminescence quenching and dielectric duple bistable switching.  Inorganic Chemistry Frontiers,      [PMID:] [10.1039/D4QI00303A]