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【结 构 式】

【分子编号】18004

【品名】5,6-dichloro-2,1,3-benzoselenadiazole

【CA登记号】

【 分 子 式 】C6H2Cl2N2Se

【 分 子 量 】251.96076

【元素组成】C 28.6% H 0.8% Cl 28.14% N 11.12% Se 31.34%

与该中间体有关的原料药合成路线共 1 条

合成路线1

该中间体在本合成路线中的序号:(V)

Phenylenediamine (IV) was protected as the benzoselenadiazole (V) on treatment with selenium dioxide in 1 N HCl. The subsequent nitration with nitric and sulfuric acid provided (VI), which on stirring with a mixture of concentrated HCl and HI gave the nitrodiamine (VII). Cyclization of (VII) with labeled diethyl oxalate (III) in sulfuric acid at 175 C yielded labeled quinoxalinedione.

1 Thorell, J.O.; et al.; Synthesis of a C-11-labelled nitrated 1,4-dihydroquinoxaline-2,3-dione, the NMDA glycine receptor antagonist ACEA 1021 (Licostinel). J Label Compd Radiopharm 1998, 41, 4, 345-353.
中间体序号 中间体编号 品名 CAS号 分子式 供应商 用于合成
(III) 17571 Diethyl oxalate; Ethyl 2-ethoxy-2-oxoacetate 95-92-1 C6H10O4 详情 详情
(III) 45301 ethyl 2-ethoxy-2-oxoacetate C6H10O4 详情 详情
(IV) 18003 4,5-dichloro-1,2-benzenediamine; 4,5-Dichloro-o-phenylenediamine; 2-amino-4,5-dichlorophenylamine 5348-42-5 C6H6Cl2N2 详情 详情
(V) 18004 5,6-dichloro-2,1,3-benzoselenadiazole C6H2Cl2N2Se 详情 详情
(VI) 18005 5,6-dichloro-4-nitro-2,1,3-benzoselenadiazole C6HCl2N3O2Se 详情 详情
(VII) 18006 2-amino-4,5-dichloro-3-nitrophenylamine; 4,5-dichloro-3-nitro-1,2-benzenediamine C6H5Cl2N3O2 详情 详情
Extended Information