DECAHYDRO-PYRAZINO[2,3-B]PYRAZINE

Base Information

• Chemical Name: DECAHYDRO-PYRAZINO[2,3-B]PYRAZINE
• CAS No.: 5409-42-7
• Molecular Formula: C6H14N4
• Molecular Weight: 142.204
• Hs Code.: 2933990090
• European Community (EC) Number: 226-479-8
• NSC Number: 12462
• UNII: 6R32W5C4SB
• DSSTox Substance ID: DTXSID7063845
• Nikkaji Number: J1.689.383H,J217.975J
• Wikidata: Q81991049
• ChEMBL ID: CHEMBL1723137
• Mol file: 5409-42-7.mol

Synonyms:1,4,5,8-Tetraazadecalin;2,5,7,10-Tetraazabicyclo[4.4.0]decane;

Chemical Property of DECAHYDRO-PYRAZINO[2,3-B]PYRAZINE

Chemical Property:

• Vapor Pressure: 2.19E-12mmHg at 25°C
• Melting Point: 180-210 °C
• Refractive Index: 1.693
• Boiling Point: 272.4 °C at 760 mmHg
• PKA: 10.47±0.20(Predicted)
• Flash Point: 128.8 °C
• PSA: 48.12000
• Density: 0.997 g/cm³
• LogP: -0.66060
• Storage Temp.: 2-8°C
• XLogP3: -1.6
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 142.121846464
• Heavy Atom Count: 10
• Complexity: 90.3

Purity/Quality:

98%min ^*data from raw suppliers

Decahydropyrazino[2,3-b]pyrazine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CNC2C(N1)NCCN2

Technology Process of DECAHYDRO-PYRAZINO[2,3-B]PYRAZINE

There total 10 articles about DECAHYDRO-PYRAZINO[2,3-B]PYRAZINE 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: 80.0%

glyoxal trimer dihydrate (4405-13-4) + ethylenediamine (107-15-3,85404-18-8) → decahydropyrazino[2,3-b]pyrazine (5409-42-7)

Guidance literature:

With acetic acid; In ethanol; at 0 - 80 ℃; for 0.666667h;

DOI:10.2174/1570178611310030009

Reference yield:

C26H34N6O4(2+)*2I(1-) + ethylenediamine (107-15-3,85404-18-8) → decahydropyrazino[2,3-b]pyrazine (5409-42-7) + C24H34N6O4*2HI

Guidance literature:

In dichloromethane; at 20 ℃;

DOI:10.1016/j.tet.2015.04.021

Reference yield:

ethylenediamine (107-15-3,85404-18-8) + C18H32N4O4(2+)*2Br(1-) → decahydropyrazino[2,3-b]pyrazine (5409-42-7) + C16H32N4O4*2BrH

Guidance literature:

In dichloromethane; at 20 ℃;

DOI:10.1016/j.tet.2015.04.021

upstream raw materials:

Glyoxal

ethylenediamine

water

glyoxal trimer dihydrate

Downstream raw materials:

cyclen-glyoxal

piperazine

Refernces

• 1、 Huang, Rui,Xie, Chunsong,Huang, Lin,Liu, Jinhua. "A novel synthesis of 1,4,7,10-tetraazacyclododecane by the tandem reaction of a vinylsulfonium salt". . p. 195 - 198. Retrieved 2013/07/26.
• 2、 -. "Trans-1,4,5,8-tetranitro-1,4,5,8-tetraazadecalin". . . Retrieved 2008/06/13.