6,9-Dioxa-3,12,18-triazabicyclo[12.3.1]octadeca-1(18)14,16-triene-2,13-dione

Base Information

• Chemical Name: 6,9-Dioxa-3,12,18-triazabicyclo[12.3.1]octadeca-1(18)14,16-triene-2,13-dione
• CAS No.: 54945-27-6
• Molecular Formula: C13H17N3O4
• Molecular Weight: 279.29178
• Mol file: 54945-27-6.mol

Synonyms:6,9-Dioxa-3,12,18-triazabicyclo[12.3.1]octadeca-1(18)14,16-triene-2,13-dione

Chemical Property of 6,9-Dioxa-3,12,18-triazabicyclo[12.3.1]octadeca-1(18)14,16-triene-2,13-dione

Chemical Property:

• PSA: 89.55000
• LogP: 0.24560

Purity/Quality:

99% ^*data from raw suppliers

6,9-DIOXA-3,12,18-TRIAZABICYCLO[12.3.1]OCTADECA-1(18)14,16-TRIENE-2,13-DIONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

Technology Process of 6,9-Dioxa-3,12,18-triazabicyclo[12.3.1]octadeca-1(18)14,16-triene-2,13-dione

There total 3 articles about 6,9-Dioxa-3,12,18-triazabicyclo[12.3.1]octadeca-1(18)14,16-triene-2,13-dione 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: 84.0%

2,6-bis(methoxycarbonyl)pyridine (5453-67-8) + 3,6-dioxa-1,8-diaminooctane (929-59-9,892154-56-2) → 6,9-dioxa-3,12,18-triazabicyclo[12.3.1]octadeca-1(18),14,16-triene-2,13-dione (54945-27-6) + 6,9,23,26-tetraoxa-3,12,20,29,35,36-hexaazatricyclo[29.3.1.114,18]hexatriaconta-1(34),14,16,18(36),31(35),32-hexaene-2,13,19,30-tetraone

Guidance literature:

With sodium methylate; In methanol; at 20 ℃; for 8h;

DOI:10.1055/s-1999-2798

Reference yield: 77.0%

2,6-bis(methoxycarbonyl)pyridine (5453-67-8) + 3,6-dioxa-1,8-diaminooctane (929-59-9,892154-56-2) → 6,9-dioxa-3,12,18-triazabicyclo[12.3.1]octadeca-1(18),14,16-triene-2,13-dione (54945-27-6)

Guidance literature:

With sodium or potassium carbonate; In methanol; at 20 ℃; for 168h;

DOI:10.1002/poc.3526

Reference yield:

2,6-Pyridinedicarbonyl dichloride (3739-94-4) + 3,6-dioxa-1,8-diaminooctane (929-59-9,892154-56-2) → 6,9-dioxa-3,12,18-triazabicyclo[12.3.1]octadeca-1(18),14,16-triene-2,13-dione (54945-27-6)

Guidance literature:

In benzene;

upstream raw materials:

2,6-Pyridinedicarbonyl dichloride

3,6-dioxa-1,8-diaminooctane

2,6-bis(methoxycarbonyl)pyridine

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