5-甲基-2-(2,4,6-三氟苯基)-2H-吡唑-3-胺结构式
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常用名 | 5-甲基-2-(2,4,6-三氟苯基)-2H-吡唑-3-胺 | 英文名 | 5-methyl-2-(2,4,6-trichlorophenyl)pyrazol-3-amine |
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| CAS号 | 106259-87-4 | 分子量 | 276.55000 | |
| 密度 | 1.57g/cm3 | 沸点 | 419.2ºC at 760 mmHg | |
| 分子式 | C10H8Cl3N3 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 207.3ºC |
| 中文名 | 5-甲基-2-(2,4,6-三氟苯基)-2H-吡唑-3-胺 |
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| 英文名 | 5-methyl-2-(2,4,6-trichlorophenyl)pyrazol-3-amine |
| 中文别名 | 5-氨基-3-甲基-1-(2,4,6-三氯苯基)吡唑 |
| 英文别名 | 更多 |
| 密度 | 1.57g/cm3 |
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| 沸点 | 419.2ºC at 760 mmHg |
| 分子式 | C10H8Cl3N3 |
| 分子量 | 276.55000 |
| 闪点 | 207.3ºC |
| 精确质量 | 274.97800 |
| PSA | 43.84000 |
| LogP | 4.30430 |
| InChIKey | ABLOGSPAFQBNMG-UHFFFAOYSA-N |
| SMILES | Cc1cc(N)n(-c2c(Cl)cc(Cl)cc2Cl)n1 |
| 蒸汽压 | 3.1E-07mmHg at 25°C |
| 折射率 | 1.674 |
| 计算化学 | 1.疏水参数计算参考值(XlogP):3.8 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:1 5.互变异构体数量:3 6.拓扑分子极性表面积43.8 7.重原子数量:16 8.表面电荷:0 9.复杂度:242 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 | 2933199090 |
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5-甲基-2-(2,4,6-三... 106259-87-4 |
| 文献:Pfizer Inc. Patent: US5712303 A1, 1998 ; US 5712303 A |
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5-甲基-2-(2,4,6-三... 106259-87-4 |
| 文献:Bayer Aktiengesellschaft Patent: US4804675 A1, 1989 ; |
| 5-甲基-2-(2,4,6-三氟苯基)-2H-吡唑-3-胺上游产品 3 | |
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| 5-甲基-2-(2,4,6-三氟苯基)-2H-吡唑-3-胺下游产品 0 | |
| 海关编码 | 2933199090 |
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| 中文概述 | 2933199090. 其他结构上有非稠合吡唑环化合物. 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 | 2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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实验名称:Cell-based high throughput primary assay to identify activators of GPR151
来源:The Scripps Research Institute Molecular Screening Center
靶标:RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id:GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
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实验名称:AlphaScreen-based biochemical high throughput primary assay to identify activators of...
来源:The Scripps Research Institute Molecular Screening Center
靶标:N/A
External Id:FBW7_ACT_ALPHA_1536_1X%ACT PRUN
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实验名称:AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of...
来源:The Scripps Research Institute Molecular Screening Center
External Id:MITF_INH_Alpha_1536_1X%INH PRUN
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| 5-methyl-2-(2,4,6-trichlorophenyl)-2h-pyrazol-3-ylamine |
| T0515-8561 |
| 3-Amino-2-(2,4,6-trichlorophenyl)-5-methylpyrazole |
| 5-amino-3-methyl-1-(2,4,6-trichlorophenyl)pyrazole |
| 1H-Pyrazol-5-amine,3-methyl-1-(2,4,6-trichlorophenyl) |