4-氨基-7-氯喹啉结构式
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常用名 | 4-氨基-7-氯喹啉 | 英文名 | 7-Chloro-4-quinolinamine |
|---|---|---|---|---|
| CAS号 | 1198-40-9 | 分子量 | 178.618 | |
| 密度 | 1.4±0.1 g/cm3 | 沸点 | 366.8±27.0 °C at 760 mmHg | |
| 分子式 | C9H7ClN2 | 熔点 | 96-97°C | |
| MSDS | 中文版 美版 | 闪点 | 175.7±23.7 °C | |
| 符号 |
GHS06 |
信号词 | Danger |
| 中文名 | 4-氨基-7-氯喹啉 |
|---|---|
| 英文名 | 7-Chloroquinolin-4-amine |
| 英文别名 | 更多 |
| 密度 | 1.4±0.1 g/cm3 |
|---|---|
| 沸点 | 366.8±27.0 °C at 760 mmHg |
| 熔点 | 96-97°C |
| 分子式 | C9H7ClN2 |
| 分子量 | 178.618 |
| 闪点 | 175.7±23.7 °C |
| 精确质量 | 178.029770 |
| PSA | 38.91000 |
| LogP | 2.38 |
| InChIKey | NDRZSRWMMUGOBP-UHFFFAOYSA-N |
| SMILES | Nc1ccnc2cc(Cl)ccc12 |
| 蒸汽压 | 0.0±0.8 mmHg at 25°C |
| 折射率 | 1.712 |
| 储存条件 | 2-8℃,避光,惰性气体保存 |
| 水溶解性 | REACTS |
| 分子结构 | 1、 摩尔折射率:51.31 2、 摩尔体积(cm3/mol):131.0 3、 等张比容(90.2K):366.9 4、 表面张力(dyne/cm):61.5 5、 极化率(10-24cm3):20.34 |
| 计算化学 | 1.疏水参数计算参考值(XlogP):无 2.氢键供体数量:1 3.氢键受体数量:2 4.可旋转化学键数量:0 5.互变异构体数量:3 6.拓扑分子极性表面积38.9 7.重原子数量:12 8.表面电荷:0 9.复杂度:163 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 |
| 更多 | 1.密度(g/cm3):1.363 2.沸点(760 mmHg,ºC):366.8 3.闪点(ºC):175.7 |
| 符号 |
GHS06 |
|---|---|
| 信号词 | Danger |
| 危害声明 | H301-H319 |
| 警示性声明 | P301 + P310-P305 + P351 + P338 |
| 危害码 (欧洲) | C |
| 风险声明 (欧洲) | R34:Causes burns. R40:Limited evidence of a carcinogenic effect. R14:Reacts violently with water. |
| 安全声明 (欧洲) | S23-S24/25-S26-S36/37/39-S45-S22 |
| 危险品运输编码 | UN 3265 8/PG 2 |
| WGK德国 | 2 |
| RTECS号 | RR4584700 |
| 包装等级 | II |
| 危险类别 | 4.1 |
| 海关编码 | 29420000 |
| 海关编码 | 2933499090 |
|---|---|
| 中文概述 | 2933499090. 其他含喹琳或异喹啉环系的化合物〔但未进一步稠合的〕. 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 | 2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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Overcoming drug resistance to heme-targeted antimalarials by systematic side chain variation of 7-chloro-4-aminoquinolines.
J. Med. Chem. 51(7) , 1995-8, (2008) Systematic variation of the branching and basicity of the side chain of chloroquine yielded a series of new 7-chloro-4-aminoquinoline derivatives exhibiting high in vitro activity against four differe... |
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New chimeric antimalarials with 4-aminoquinoline moiety linked to a tetraoxane skeleton.
J. Med. Chem. 51(19) , 6216-9, (2008) The synthesis of the chimeric molecules consisting of two pharmacophores, tetraoxane and 7-chloro-4-aminoquinoline, is reported. The tetraoxanes 2, 4, and 8 show relatively potent in vitro antimalaria... |
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An ELISA test for detecting chloroquine in urine.
Trans. R. Soc. Trop. Med. Hyg. 82(2) , 216-20, (1988) Two ELISA tests for detecting chloroquine in urine have been developed using polyclonal and monoclonal antibodies which react with the 7-chloro-4-amino-quinoline part of the chloroquine molecule and t... |
| 7-chloroquinolin-4-amine |
| 4-Amino-7-chloroquinoline |
| 7-Chloro-4-quinolinamine |
| 7-chloro-quinolin-4-ylamine |
| 7-chloro-4-aminoquinoline |
| MFCD00828822 |