1-[6-(Diethylamino)-2-hexynyl]pyrrolidine

Base Information

• Chemical Name: 1-[6-(Diethylamino)-2-hexynyl]pyrrolidine
• CAS No.: 6628-90-6
• Molecular Formula: C14H26N2
• Molecular Weight: 222.37
• European Community (EC) Number: 654-712-7
• NSC Number: 59770
• UNII: 1E1744IHA4
• DSSTox Substance ID: DTXSID00216487
• Nikkaji Number: J51.446B
• Wikidata: Q83092717
• Mol file: 6628-90-6.mol

Synonyms:1-[6-(Diethylamino)-2-hexynyl]pyrrolidine;6628-90-6;6-Diethylamino-1-pyrrolidino-2-hexyne;Pyrrolidine, 1-(6-(diethylamino)-2-hexynyl)-;N,N-diethyl-6-pyrrolidin-1-ylhex-4-yn-1-amine;1-(6-(Diethylamino)-2-hexynyl)pyrrolidine;1E1744IHA4;NSC-59770;Pyrrolidine, 1-[6-(diethylamino)-2-hexynyl]-;NSC 59770;BRN 0130336;NSC59770;4-20-00-00248 (Beilstein Handbook Reference);UNII-1E1744IHA4;DTXSID00216487;AKOS024323029;4-HEXYN-1-AMINE, N,N-DIETHYL-6-(1-PYRROLIDINYL)-

Chemical Property of 1-[6-(Diethylamino)-2-hexynyl]pyrrolidine

Chemical Property:

• Vapor Pressure: 0.000886mmHg at 25°C
• Boiling Point: 304.2°C at 760 mmHg
• Flash Point: 126.4°C
• PSA: 6.48000
• Density: 0.926g/cm³
• LogP: 2.14550
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 6
• Exact Mass: 222.209598838
• Heavy Atom Count: 16
• Complexity: 226

Purity/Quality:

Diethyl-(6-pyrrolidin-1-yl-hex-4-ynyl)-amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)CCCC#CCN1CCCC1

Technology Process of 1-[6-(Diethylamino)-2-hexynyl]pyrrolidine

There total 1 articles about 1-[6-(Diethylamino)-2-hexynyl]pyrrolidine 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:

1-(prop-2-yn-1-yl)pyrrolidine (7223-42-9) + 3-diethylaminopropyl chloride (104-77-8) → 1-(6-diethylamino-hex-2-ynyl)-pyrrolidine (6628-90-6)

Guidance literature:

With sodium amide;

DOI:10.1021/ja01550a049

upstream raw materials:

1-(prop-2-yn-1-yl)pyrrolidine

3-diethylaminopropyl chloride