HRID2258396

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID6227

Bromoacetic acid

C2H3BrO2

结构：CCC(Cc1c(I)cc(I)c(NC(=O)CN2CCNCCNCCNCC2)c1I)C(=O)O

HCID22921399

未命名化合物

结构：O=C(CN1CCNCCNCCNCC1)Nc1c(I)cc(I)c(C(=O)O)c1I

HCID22921403

未命名化合物

PRODUCTS

生成物

结构：CCC(Cc1c(I)cc(I)c(NC(=O)CN2CCN(CC(=O)O)CCN(CC(=O)O)CCN(CC(=O)O)CC2)c1I)C(=O)O

HCID10677949

未命名化合物

收率 13.4%

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID962

Water

H2O

2 次

PROCEDURE

实验过程

According to the procedure described in Example 3, 17.74 g of bromoacetic acid (0.127 mol) in 20 ml of H2O are reacted with 25 g of compound (B) N-[3-(2-carboxybutyl)-2,4,6-triiodophenyl]-1,4,7,10-tetraazacyclododecane-1-acetamide (0.032 mol) in 20 ml of H2O. 4.1 g of 10-[2-[[3-(2-carboxybutyl)-2,4,6-triiodophenyl]amino]-2-oxoethyl ] -1,4,7,10-tetraazacyclododecane-1,4,7-triacetic acid (0.0043 mol) are obtained.

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-7908b8e73bc143ccb30229fadcbb398a
来源数据集: uspto-grants-1997_08
DOI: 10.6084/m9.figshare.5104873.v1
专利: US05660814
来源说明: uspto-grants-1997_08

反应 SMILES

Br[CH2:2][C:3]([OH:5])=[O:4].[C:6]([C:9]1C(I)=C(NC(=O)CN2CCNCCNCCNCC2)C(I)=CC=1I)([OH:8])=[O:7].[C:34]([CH:37]([CH2:64][CH3:65])[CH2:38][C:39]1[C:40]([I:63])=[C:41]([NH:47][C:48](=[O:62])[CH2:49][N:50]2[CH2:61][CH2:60][NH:59][CH2:58][CH2:57][NH:56][CH2:55][CH2:54][NH:53][CH2:52][CH2:51]2)[C:42]([I:46])=[CH:43][C:44]=1[I:45])([OH:36])=[O:35]>O>[C:34]([CH:37]([CH2:64][CH3:65])[CH2:38][C:39]1[C:40]([I:63])=[C:41]([NH:47][C:48](=[O:62])[CH2:49][N:50]2[CH2:51][CH2:52][N:53]([CH2:2][C:3]([OH:5])=[O:4])[CH2:54][CH2:55][N:56]([CH2:2][C:3]([OH:5])=[O:4])[CH2:57][CH2:58][N:59]([CH2:9][C:6]([OH:8])=[O:7])[CH2:60][CH2:61]2)[C:42]([I:46])=[CH:43][C:44]=1[I:45])([OH:36])=[O:35]