Triethylamine nitrate

Base Information

• Chemical Name: Triethylamine nitrate
• CAS No.: 27096-31-7
• Molecular Formula: C6H16N2O3
• Molecular Weight: 164.205
• Hs Code.: 2923900090
• European Community (EC) Number: 248-223-4
• DSSTox Substance ID: DTXSID30181558
• Mol file: 27096-31-7.mol

Synonyms:EINECS 248-223-4;27096-31-7;triethylamine nitrate;SCHEMBL724142;DTXSID30181558

Chemical Property of Triethylamine nitrate

Chemical Property:

• Vapor Pressure: 56.1mmHg at 25°C
• Melting Point: 112 °C
• Refractive Index: 1.5300 (estimate)
• Boiling Point: 90.5°Cat760mmHg
• Flash Point: °C
• PSA: 73.32000
• Density: g/cm³
• LogP: 0.21510
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 164.11609238
• Heavy Atom Count: 11
• Complexity: 50.4

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)CC.[N+](=O)(O)[O-]

Technology Process of Triethylamine nitrate

There total 4 articles about Triethylamine nitrate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 71.0%

triethylamine (121-44-8) → triethylammonium nitrate (27096-31-7)

Guidance literature:

With nitric acid; at 0 ℃; for 1h;

DOI:10.1007/s11164-017-2932-5

Reference yield:

nitric acid (7697-37-2,78989-43-2) + triethylamine (121-44-8) → triethylammonium nitrate (27096-31-7)

Guidance literature:

at 80 ℃;

DOI:10.1080/00304948.2015.1088757

Reference yield:

triethylamine (121-44-8) → triethylammonium nitrite (94787-56-1) + triethylammonium nitrate (27096-31-7)

Guidance literature:

With dinitrogen trioxide; In toluene;

DOI:10.1002/ejic.201800654

upstream raw materials:

triethylamine

nitric acid

Refernces

• 1、 Volkova, Yulia A.,Averina, Elena B.,Vasilenko, Dmitry A.,Sedenkova, Kseniya N.,Grishin, Yuri K.,Bruheim, Per,Kuznetsova, Tamara S.,Zefirov, Nikolai S.. "RETRACTED ARTICLE: Unexpected Heterocyclization of Electrophilic Alkenes by Tetranitromethane in the Presence of Triethylamine. Synthesis of 5-Nitroisoxazoles". . p. 3192 - 3200. Retrieved 2019/03/20.
• 2、 Rosadiuk, Kristopher A.,Scott Bohle. "Isolable Adducts of Tertiary Amines and Dinitrogen Trioxide". . p. 4543 - 4549. Retrieved 2018/10/31.