1-(4-(Diethylamino)-3-methylbenzyl)-4-hexyl-2,3-piperazinedione

Base Information

• Chemical Name: 1-(4-(Diethylamino)-3-methylbenzyl)-4-hexyl-2,3-piperazinedione
• CAS No.: 77918-02-6
• Molecular Formula: C22H35 N3 O2
• Molecular Weight: 0
• Hs Code.: 2933599090
• DSSTox Substance ID: DTXSID30228578
• Nikkaji Number: J117.825C
• Wikidata: Q83108586
• Mol file: 77918-02-6.mol

Synonyms:77918-02-6;1-(4-(Diethylamino)-3-methylbenzyl)-4-hexyl-2,3-piperazinedione;BRN 5631126;2,3-Piperazinedione, 1-(4-(diethylamino)-3-methylbenzyl)-4-hexyl-;1-(4-Diethylamino-3-methyl)benzyl-4-n-hexyl-2,3-dioxopiperazine;1-[4-(Diethylamino)-3-methylbenzyl]-4-hexyl-2,3-piperazinedione;DTXSID30228578;LS-111872

Chemical Property of 1-(4-(Diethylamino)-3-methylbenzyl)-4-hexyl-2,3-piperazinedione

Chemical Property:

• Vapor Pressure: 4.79E-10mmHg at 25°C
• Boiling Point: 497.8°C at 760 mmHg
• Flash Point: 192.9°C
• PSA: 43.86000
• Density: 1.064g/cm³
• LogP: 3.46810
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 10
• Exact Mass: 373.27292737
• Heavy Atom Count: 27
• Complexity: 478

Purity/Quality:

99% ^*data from raw suppliers

1-(4-(DIETHYLAMINO)-3-METHYLBENZYL)-4-HEXYL-2,3-PIPERAZINEDIONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCN1CCN(C(=O)C1=O)CC2=CC(=C(C=C2)N(CC)CC)C

Technology Process of 1-(4-(Diethylamino)-3-methylbenzyl)-4-hexyl-2,3-piperazinedione

There total 1 articles about 1-(4-(Diethylamino)-3-methylbenzyl)-4-hexyl-2,3-piperazinedione 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: 72.2%

ethyl iodide (75-03-6) + 1-(4-amino-3-methyl)benzyl-4-n-hexyl-2,3-dioxopiperazine (77917-99-8) → 1-(4-diethylamino-3-methyl)benzyl-4-n-hexyl-2,3-dioxopiperazine (77918-02-6)

Guidance literature:

With potassium carbonate; In N,N-dimethyl-formamide; at 90 ℃; for 0.166667h;

DOI:10.1248/cpb.29.1253

upstream raw materials:

ethyl iodide

1-(4-amino-3-methyl)benzyl-4-n-hexyl-2,3-dioxopiperazine