171897-74-8
中文名稱
脫乙酰碘克沙醇
英文名稱
Deacetyl Iodixanol
CAS
171897-74-8
分子式
C33H42I6N6O14
分子量
1508.15
MOL 文件
171897-74-8.mol
更新日期
2025/12/10 20:42:37
171897-74-8 結(jié)構(gòu)式
基本信息
中文別名
脫乙酰碘克沙醇去乙酰碘克沙醇
去乙?；饪松炒?BR>碘克沙醇雜質(zhì)C(EP/BP)
碘克沙醇相關(guān)化合物C(USP)
英文別名
Deacetyl IodixanolDesacetyl Iodixanol
Iodixanol impurity C
Iodixanol EP impurity C
Iodixanol Impurity 3(Iodixanol EP Impurity C)
5-[[3-[N-acetyl-3,5-bis(2,3-dihydroxypropylcarbamoyl)-2,4,6-triiodoanilino]-2-hydroxypropyl]amino]-1-N,3-N-bis(2,3-dihydroxypropyl)-2,4,6-triiodobenzene-1,3-dicarboxamide
5-[Acetyl[3-[[3,5-bis[(2,3-dihydroxypropyl)carbamoyl]-2,4,6-triiodophenyl]amino]-2-hydroxypropyl]amino]-N,N′-bis(2,3-dihydroxypropyl)-2,4,6-triiodobenzene-1,3-dicarboxamide
5-[Acetyl[3-[[3,5-bis[[(2,3-dihydroxypropyl)aMino]carbonyl]-2,4,6-triiodophenyl]aMino]-2-hydroxypropyl]aMino]-N,N'-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-1,3-benzenedicarboxaMide
1,3-Benzenedicarboxamide, 5-[acetyl[3-[[3,5-bis[[(2,3-dihydroxypropyl)amino]carbonyl]-2,4,6-triiodophenyl]amino]-2-hydroxypropyl]amino]-N1,N3-bis(2,3-dihydroxypropyl)-2,4,6-triiodo-
所屬類別
分析化學(xué)：藥典標(biāo)準(zhǔn)品和雜質(zhì)標(biāo)準(zhǔn)品物理化學(xué)性質(zhì)
沸點(diǎn)1197.2±65.0 °C(Predicted)
密度2.344±0.06 g/cm3(Predicted)
儲(chǔ)存條件2-8°C
酸度系數(shù)(pKa)11.34±0.46(Predicted)
形態(tài)neat
主要應(yīng)用pharmaceutical (small molecule)
InChIKeyRREZWVKPVJDLJN-UHFFFAOYSA-N
SMILESC1(C(NCC(O)CO)=O)=C(I)C(N(C(C)=O)CC(O)CNC2=C(I)C(C(NCC(O)CO)=O)=C(I)C(C(NCC(O)CO)=O)=C2I)=C(I)C(C(NCC(O)CO)=O)=C1I