2,2-Diethoxy-N-ethyl-1-ethanamine

Base Information

• Chemical Name: 2,2-Diethoxy-N-ethyl-1-ethanamine
• CAS No.: 69148-92-1
• Molecular Formula: C8H19NO2
• Molecular Weight: 161.24
• DSSTox Substance ID: DTXSID50500606
• Wikidata: Q82352338
• Mol file: 69148-92-1.mol

Synonyms:69148-92-1;2,2-diethoxy-N-ethylethanamine;2,2-DIETHOXY-N-ETHYL-1-ETHANAMINE;(2,2-DIETHOXY-ETHYL)-ETHYL-AMINE;2,2-Diethoxy-N-ethyl-ethanamine;(2,2-diethoxyethyl)(ethyl)amine;Ethanamine, 2,2-diethoxy-N-ethyl-;2,2-Diethoxy-N-ethylethan-1-amine;SCHEMBL2263311;DTXSID50500606;YSCNYKGRVUVJHA-UHFFFAOYSA-N;ethylaminoacetaldehyde diethylacetal;MFCD04972437;N-ethyl-N-(2,2-diethoxyethyl)amine;AKOS006242771;CS-0242459;EN300-249594;F16444

Chemical Property of 2,2-Diethoxy-N-ethyl-1-ethanamine

Chemical Property:

• Vapor Pressure: 0.698mmHg at 25°C
• Refractive Index: 1.419
• Boiling Point: 185.4°C at 760 mmHg
• PKA: 8.52±0.28(Predicted)
• Flash Point: 73.7°C
• PSA: 30.49000
• Density: 0.883g/cm³
• LogP: 1.38590
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 7
• Exact Mass: 161.141578849
• Heavy Atom Count: 11
• Complexity: 72.5

Purity/Quality:

98.5% ^*data from raw suppliers

2,2-Diethoxy-N-ethylethanamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCNCC(OCC)OCC
• Uses: 2,2-Diethoxy-N-ethylethanamine is used in the preparation of 1-substituted-2-mercaptoimidazoles with antithyroid activity.

Technology Process of 2,2-Diethoxy-N-ethyl-1-ethanamine

There total 6 articles about 2,2-Diethoxy-N-ethyl-1-ethanamine 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: 74.3%

ethylamine (75-04-7,85404-22-4) + Bromoacetaldehyde diethyl acetal (2032-35-1) → N-ethylamino-acetaldehyde diethyl acetal (69148-92-1)

Guidance literature:

In methanol; for 24h; Heating;

DOI:10.1016/S0957-4166(00)82385-X

Reference yield: 64.0%

N-(2,2-diethoxyethyl)-N-ethyl-4-methoxyaniline → N-ethylamino-acetaldehyde diethyl acetal (69148-92-1)

Guidance literature:

With ammonium cerium (IV) nitrate; water; In acetonitrile; at 0 ℃; for 0.166667h;

DOI:10.1002/adsc.201801670

Reference yield: 22.0%

ethanol (64-17-5) + diethylamine (109-89-7) → N-ethylamino-acetaldehyde diethyl acetal (69148-92-1) + N-(2,2-diethoxyethyl)-2,2-diethoxy-N-ethylethan-1-amine

Guidance literature:

With Cumene hydroperoxide; iodine; In acetonitrile; at 100 ℃; for 12h; Molecular sieve; Sealed tube; Inert atmosphere; Green chemistry;

DOI:10.1002/adsc.201801670

upstream raw materials:

ethylamine

Bromoacetaldehyde diethyl acetal

chloroacetaldehyde diethyl acetal

ethanol

Downstream raw materials:

2-mercapto-1-ethylimidazole

C₁₇H₂₈N₄O₆

2-amino-1-ethylimidazole