4-(2-Diethylaminoethyl)pyridine

Base Information

• Chemical Name: 4-(2-Diethylaminoethyl)pyridine
• CAS No.: 67580-61-4
• Molecular Formula: C11H18N2
• Molecular Weight: 178.277
• Hs Code.: 2933399090
• NSC Number: 63370
• DSSTox Substance ID: DTXSID20289754
• Wikidata: Q82027209
• Mol file: 67580-61-4.mol

Synonyms:4-(2-Diethylaminoethyl)pyridine;67580-61-4;N,N-Diethyl-2-(pyridin-4-yl)ethanamine;N,N-diethyl-2-pyridin-4-ylethanamine;N1,N1-diethyl-2-(4-pyridyl)ethan-1-amine;N,N-diethyl-2-(pyridin-4-yl)ethan-1-amine;NSC63370;SCHEMBL3031908;DTXSID20289754;CHEBI:195028;4-Pyridineethanamine,N,N-diethyl-;MFCD00023637;NSC-63370;AKOS006228159;SB53314;N,N-diethyl-2-(4-pyridinyl)ethanamine;CS-0368053;FT-0641130

Chemical Property of 4-(2-Diethylaminoethyl)pyridine

Chemical Property:

• Vapor Pressure: 0.00736mmHg at 25°C
• Refractive Index: 1.506
• Boiling Point: 269.2 °C at 760 mmHg
• Flash Point: 116.6 °C
• PSA: 16.13000
• Density: 0.944 g/cm³
• LogP: 1.96590
• XLogP3: 1.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 178.146998583
• Heavy Atom Count: 13
• Complexity: 115

Purity/Quality:

98%min ^*data from raw suppliers

diethyl[2-(pyridin-4-yl)ethyl]amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)CCC1=CC=NC=C1

Technology Process of 4-(2-Diethylaminoethyl)pyridine

There total 2 articles about 4-(2-Diethylaminoethyl)pyridine 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: 53.0%

4-vinylpyridine (100-43-6,329041-72-7) + diethylamine (109-89-7) → 4-<2-(diethylamino)ethyl>pyridine (67580-61-4)

Guidance literature:

With acetic acid; In isopropyl alcohol; for 168h; Heating;

DOI:10.1021/jm00379a020

Reference yield:

4-vinylpyridine (100-43-6,329041-72-7) → 4-<2-(diethylamino)ethyl>pyridine (67580-61-4)

Guidance literature:

DOI:10.1021/ja01598a066 DOI:10.1139/v54-068

Reference yield:

4-<2-(diethylamino)ethyl>pyridine (67580-61-4) → ethylsulfanyl-diphenyl-acetic acid 2-[4-(2-diethylamino-ethyl)-piperidin-1-yl]-ethyl ester

Guidance literature:

Multi-step reaction with 3 steps

1: H₂; aq. HCl / PtO₂ / methanol / 24 h / 2482.31 Torr

2: NEt₃ / ethanol / 24 h / Heating

3: CH₂Cl₂ / 48 h / Heating

With hydrogenchloride; hydrogen; triethylamine; platinum(IV) oxide; In methanol; ethanol; dichloromethane;

DOI:10.1016/j.farmac.2004.08.003

upstream raw materials:

4-vinylpyridine

diethylamine

Refernces

• 1、 Gray,Platz,Chang,Leverone,Ferrick,Kramer. "Synthesis of some quaternary ammonium alkylating agents and their effects on soman-inhibited acetylcholinesterase". . p. 111 - 116. Retrieved 2007/10/02.