2,2',2''-(10-(2-(bis(carboxymethyl)amino)-5-(4-isothiocyanatophenyl)pentyl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic Acid

Base Information

Chemical Name:2,2',2''-(10-(2-(bis(carboxymethyl)amino)-5-(4-isothiocyanatophenyl)pentyl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic Acid
CAS No.:1258945-77-5
Molecular Formula:C₃₀H₄₄N₆O₁₀S
Molecular Weight:680.78
Hs Code.:

Synonyms:2,2',2''-(10-(2-(bis(carboxymethyl)amino)-5-(4-isothiocyanatophenyl)pentyl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic Acid

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Chemical Property of 2,2',2''-(10-(2-(bis(carboxymethyl)amino)-5-(4-isothiocyanatophenyl)pentyl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic Acid

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Technology Process of 2,2',2''-(10-(2-(bis(carboxymethyl)amino)-5-(4-isothiocyanatophenyl)pentyl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic Acid

There total 10 articles about 2,2',2''-(10-(2-(bis(carboxymethyl)amino)-5-(4-isothiocyanatophenyl)pentyl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic Acid 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: 100.0%

: 463-71-8
thiophosgene

: 1258945-74-2
2,2',2''-(10-(5-(4-Aminophenyl)-2-(bis(carboxymethyl)-amino)pentyl)-1,4,7,10-tetraaza-cyclododecane-1,4,7-triyl)-triacetic acid

: 1258945-77-5
2,2',2''-(10-(2-(bis(carboxymethyl)amino)-5-(4-isothiocyanatophenyl)pentyl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic Acid

Guidance literature:: In chloroform; water; at 20 ℃; for 2h;
DOI:10.1021/bc100586y

Reference yield: 100.0%

: 3p-C-DEPA-NCS

: 1258945-77-5
2,2',2''-(10-(2-(bis(carboxymethyl)amino)-5-(4-isothiocyanatophenyl)pentyl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic Acid

Guidance literature:

Reference yield:

: 122555-91-3
1,4,7-tris-tert-butoxycarbonylmethyl-1,4,7,10-tetraazacyclododecane

: 1258945-77-5
2,2',2''-(10-(2-(bis(carboxymethyl)amino)-5-(4-isothiocyanatophenyl)pentyl)-1,4,7,10-tetraazacyclododecane-1,4,7-triyl)triacetic Acid

Guidance literature:: Multi-step reaction with 4 steps

1: N-ethyl-N,N-diisopropylamine / acetonitrile / 672 h / 20 °C

2: hydrogenchloride / 1,4-dioxane / 22.33 h / 0 - 20 °C

3: palladium 10% on activated carbon; hydrogen / water / 19 h / 775.74 Torr

4: chloroform; water / 2 h / 20 °C

With hydrogenchloride; palladium 10% on activated carbon; hydrogen; N-ethyl-N,N-diisopropylamine; In 1,4-dioxane; chloroform; water; acetonitrile;
DOI:10.1021/bc100586y