[8,11-Bis-ethoxycarbonylmethyl-3-nitro-2-(2,4,6-trinitro-phenylamino)-6,7,8,9,10,11,12,13-octahydro-5-oxa-8,11,14-triaza-benzocyclododecen-14-yl]-acetic acid ethyl ester

Base Information

Chemical Name:[8,11-Bis-ethoxycarbonylmethyl-3-nitro-2-(2,4,6-trinitro-phenylamino)-6,7,8,9,10,11,12,13-octahydro-5-oxa-8,11,14-triaza-benzocyclododecen-14-yl]-acetic acid ethyl ester
CAS No.:150333-59-8
Molecular Formula:C₃₀H₃₈N₈O₁₅
Molecular Weight:750.676
Hs Code.:

[8,11-Bis-ethoxycarbonylmethyl-3-nitro-2-(2,4,6-trinitro-phenylamino)-6,7,8,9,10,11,12,13-octahydro-5-oxa-8,11,14-triaza-benzocyclododecen-14-yl]-acetic acid ethyl ester

Synonyms:[8,11-Bis-ethoxycarbonylmethyl-3-nitro-2-(2,4,6-trinitro-phenylamino)-6,7,8,9,10,11,12,13-octahydro-5-oxa-8,11,14-triaza-benzocyclododecen-14-yl]-acetic acid ethyl ester

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Chemical Property of [8,11-Bis-ethoxycarbonylmethyl-3-nitro-2-(2,4,6-trinitro-phenylamino)-6,7,8,9,10,11,12,13-octahydro-5-oxa-8,11,14-triaza-benzocyclododecen-14-yl]-acetic acid ethyl ester

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Technology Process of [8,11-Bis-ethoxycarbonylmethyl-3-nitro-2-(2,4,6-trinitro-phenylamino)-6,7,8,9,10,11,12,13-octahydro-5-oxa-8,11,14-triaza-benzocyclododecen-14-yl]-acetic acid ethyl ester

There total 9 articles about [8,11-Bis-ethoxycarbonylmethyl-3-nitro-2-(2,4,6-trinitro-phenylamino)-6,7,8,9,10,11,12,13-octahydro-5-oxa-8,11,14-triaza-benzocyclododecen-14-yl]-acetic acid ethyl ester 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: 94.0%

: 150333-58-7
[8,11-Bis-ethoxycarbonylmethyl-2-(2,4,6-trinitro-phenylamino)-6,7,8,9,10,11,12,13-octahydro-5-oxa-8,11,14-triaza-benzocyclododecen-14-yl]-acetic acid ethyl ester

: 150333-59-8
[8,11-Bis-ethoxycarbonylmethyl-3-nitro-2-(2,4,6-trinitro-phenylamino)-6,7,8,9,10,11,12,13-octahydro-5-oxa-8,11,14-triaza-benzocyclododecen-14-yl]-acetic acid ethyl ester

Guidance literature:: With nitric acid; acetic acid; In chloroform; at 0 ℃; for 0.166667h;
DOI:10.1021/jo00069a034

Reference yield:

: 99-57-0
2-hydroxy-5-nitroaniline

: 150333-59-8
[8,11-Bis-ethoxycarbonylmethyl-3-nitro-2-(2,4,6-trinitro-phenylamino)-6,7,8,9,10,11,12,13-octahydro-5-oxa-8,11,14-triaza-benzocyclododecen-14-yl]-acetic acid ethyl ester

Guidance literature:: Multi-step reaction with 8 steps

1: 43 percent / K₂CO₃ / dimethylformamide / 75 °C

2: 69 percent / pyridine / CH₂Cl₂ / 2 h / Ambient temperature

3: 57 percent / Cs₂CO₃ / dimethylformamide / 10 h

4: 94 percent / conc. H₂SO₄ / 12 h / 100 °C

5: 88 percent / K₂CO₃ / dimethylformamide / 48 h / 90 °C

6: H₂, p-toluenesulfonic acid / 10percent Pd/C / ethanol / 12 h / 2585.7 Torr / Ambient temperature

7: K₂CO₃ / methanol / 4 h / Ambient temperature

8: 94 percent / fuming HNO₃, acetic acid / CHCl₃ / 0.17 h / 0 °C

With pyridine; sulfuric acid; hydrogen; nitric acid; potassium carbonate; caesium carbonate; toluene-4-sulfonic acid; acetic acid; palladium on activated charcoal; In methanol; ethanol; dichloromethane; chloroform; N,N-dimethyl-formamide;
DOI:10.1021/jo00069a034

Reference yield:

: 91956-17-1
N-(2-hydroxy-5-nitrophenyl)-4-methylbenzenesulfonamide

: 150333-59-8
[8,11-Bis-ethoxycarbonylmethyl-3-nitro-2-(2,4,6-trinitro-phenylamino)-6,7,8,9,10,11,12,13-octahydro-5-oxa-8,11,14-triaza-benzocyclododecen-14-yl]-acetic acid ethyl ester

Guidance literature:: Multi-step reaction with 7 steps

1: 30 percent / K₂CO₃ / dimethylformamide / 1.) 60 deg C, 5 min, 2.) 60 deg C, 24 h

2: 57 percent / Cs₂CO₃ / dimethylformamide / 10 h

3: 94 percent / conc. H₂SO₄ / 12 h / 100 °C

4: 88 percent / K₂CO₃ / dimethylformamide / 48 h / 90 °C

5: H₂, p-toluenesulfonic acid / 10percent Pd/C / ethanol / 12 h / 2585.7 Torr / Ambient temperature

6: K₂CO₃ / methanol / 4 h / Ambient temperature

7: 94 percent / fuming HNO₃, acetic acid / CHCl₃ / 0.17 h / 0 °C

With sulfuric acid; hydrogen; nitric acid; potassium carbonate; caesium carbonate; toluene-4-sulfonic acid; acetic acid; palladium on activated charcoal; In methanol; ethanol; chloroform; N,N-dimethyl-formamide;
DOI:10.1021/jo00069a034