1-甲基-1H-吲哚-2-羧酸甲酯
1-甲基-1H-吲哚-2-羧酸甲酯结构式
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常用名 | 1-甲基-1H-吲哚-2-羧酸甲酯 | 英文名 | Methyl 1-methyl-1H-indole-2-carboxylate |
|---|---|---|---|---|
| CAS号 | 37493-34-8 | 分子量 | 189.21100 | |
| 密度 | 1.14g/cm3 | 沸点 | 320.2ºC at 760mmHg | |
| 分子式 | C11H11NO2 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 147.4ºC |
| 中文名 | 1-甲基-2-吲哚甲酸甲酯 |
|---|---|
| 英文名 | methyl 1-methylindole-2-carboxylate |
| 中文别名 | 甲基-1-甲基-1H-吲哚-2-羧酸酯 |
| 英文别名 | 更多 |
| 密度 | 1.14g/cm3 |
|---|---|
| 沸点 | 320.2ºC at 760mmHg |
| 分子式 | C11H11NO2 |
| 分子量 | 189.21100 |
| 闪点 | 147.4ºC |
| 精确质量 | 189.07900 |
| PSA | 31.23000 |
| LogP | 1.96490 |
| 折射率 | 1.565 |
| 储存条件 | 室温 |
| 计算化学 | 1.疏水参数计算参考值（XlogP）:无 2.氢键供体数量:0 3.氢键受体数量:2 4.可旋转化学键数量:2 5.互变异构体数量:无 6.拓扑分子极性表面积:31.2 7.重原子数量:14 8.表面电荷:0 9.复杂度:229 10.同位素原子数量:0 11.确定原子立构中心数量:0 12.不确定原子立构中心数量:0 13.确定化学键立构中心数量:0 14.不确定化学键立构中心数量:0 15.共价键单元数量:1 |
| 海关编码 | 2933990090 |
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~92%
1-甲基-1H-吲哚-2-羧酸甲酯 37493-34-8 |
| 文献：Sechi, Mario; Derudas, Massimiliano; Dallocchio, Roberto; Dessi, Alessandro; Bacchi, Alessia; Sannia, Luciano; Carta, Fabrizio; Palomba, Michele; Ragab, Omar; Chan, Carney; Shoemaker, Robert; Sei, Shizuko; Dayam, Raveendra; Neamati, Nouri Journal of Medicinal Chemistry, 2004 , vol. 47, # 21 p. 5298 - 5310 |
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~97%
1-甲基-1H-吲哚-2-羧酸甲酯 37493-34-8 |
| 文献：Dolusic, Eduard; Larrieu, Pierre; Blanc, Sebastien; Sapunaric, Frederic; Norberg, Bernadette; Moineaux, Laurence; Colette, Delphine; Stroobant, Vincent; Pilotte, Luc; Colau, Didier; Ferain, Thierry; Fraser, Graeme; Galeni, Moreno; Frre, Jean-Marie; Masereel, Bernard; Van Den Eynde, Benoit; Wouters, Johan; Frederick, Raphael Bioorganic and Medicinal Chemistry, 2011 , vol. 19, # 4 p. 1550 - 1561 |
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~93%
1-甲基-1H-吲哚-2-羧酸甲酯 37493-34-8 |
| 文献：Dell, Steven; Lozanov, Mario Emilov; Shieh, Wen-Chung Patent: US2004/59131 A1, 2004 ; Location in patent: Page 6 ; |
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~%
1-甲基-1H-吲哚-2-羧酸甲酯 37493-34-8 |
| 文献：Sankyo Company, Limited Patent: US5624935 A1, 1997 ; |
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1-甲基-1H-吲哚-2-羧酸甲酯 37493-34-8 |
| 文献：Ganton, Michael D.; Kerr, Michael A. Organic Letters, 2005 , vol. 7, # 21 p. 4777 - 4779 |
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~%
1-甲基-1H-吲哚-2-羧酸甲酯 37493-34-8 |
| 文献：Johnson et al. Journal of the American Chemical Society, 1945 , vol. 67, p. 423,428 Journal of the American Chemical Society, 1947 , vol. 69, p. 2370 |
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~%
1-甲基-1H-吲哚-2-羧酸甲酯 37493-34-8 |
| 文献：Sechi, Mario; Derudas, Massimiliano; Dallocchio, Roberto; Dessi, Alessandro; Bacchi, Alessia; Sannia, Luciano; Carta, Fabrizio; Palomba, Michele; Ragab, Omar; Chan, Carney; Shoemaker, Robert; Sei, Shizuko; Dayam, Raveendra; Neamati, Nouri Journal of Medicinal Chemistry, 2004 , vol. 47, # 21 p. 5298 - 5310 |
|
~%
1-甲基-1H-吲哚-2-羧酸甲酯 37493-34-8 |
| 文献：Sechi, Mario; Derudas, Massimiliano; Dallocchio, Roberto; Dessi, Alessandro; Bacchi, Alessia; Sannia, Luciano; Carta, Fabrizio; Palomba, Michele; Ragab, Omar; Chan, Carney; Shoemaker, Robert; Sei, Shizuko; Dayam, Raveendra; Neamati, Nouri Journal of Medicinal Chemistry, 2004 , vol. 47, # 21 p. 5298 - 5310 |
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~%
1-甲基-1H-吲哚-2-羧酸甲酯 37493-34-8 |
| 文献：Praveen, Chandrasekaran; Perumal, Paramasivan Thirumalai Synlett, 2011 , # 4 p. 521 - 524 |
| 1-甲基-1H-吲哚-2-羧酸甲酯上游产品 7 | |
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| 1-甲基-1H-吲哚-2-羧酸甲酯下游产品 10 | |
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CAS号56297-43-9| 海关编码 | 2933990090 |
|---|---|
| 中文概述 | 2933990090. 其他仅含氮杂原子的杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0% |
| 申报要素 | 品名, 成分含量, 用途, 乌洛托品请注明外观, 6－己内酰胺请注明外观, 签约日期 |
| Summary | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
| methyl N-methylindole-2-carboxylate |
| Methyl 1-methyl-1H-indole-2-carboxylate |
| 1-Methyl-1H-indole-2-carboxylic acid methyl ester |
| methyl 1-methyl-2-indolecarboxylate |
| 1-Methyl-indol-2-carbonsaeure-methylester |
| 1-methyl-indole-2-carboxylic acid methyl ester |
