N-(叔-丁基)苯甲酰胺结构式
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常用名 | N-(叔-丁基)苯甲酰胺 | 英文名 | Benzamide,N-(1,1-dimethylethyl) |
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| CAS号 | 5894-65-5 | 分子量 | 177.24300 | |
| 密度 | 1.013g/cm3 | 沸点 | 293.2ºC at 760mmHg | |
| 分子式 | C11H15NO | 熔点 | 172-174ºC | |
| MSDS | N/A | 闪点 | 131.1ºC |
| 中文名 | N-叔丁基苯酰胺 |
|---|---|
| 英文名 | n-tert-butylbenzamide |
| 英文别名 | 更多 |
| 密度 | 1.013g/cm3 |
|---|---|
| 沸点 | 293.2ºC at 760mmHg |
| 熔点 | 172-174ºC |
| 分子式 | C11H15NO |
| 分子量 | 177.24300 |
| 闪点 | 131.1ºC |
| 精确质量 | 177.11500 |
| PSA | 29.10000 |
| LogP | 2.60580 |
| InChIKey | HYWWTHOGCJXTRI-UHFFFAOYSA-N |
| SMILES | CC(C)(C)NC(=O)c1ccccc1 |
| 折射率 | 1.511 |
| 储存条件 | 2-8°C |
| 计算化学 | 1.疏水参数计算参考值(XlogP):2.2 2.氢键供体数量:1 3.氢键受体数量:1 4.可旋转化学键数量:2 5.互变异构体数量:2 6.拓扑分子极性表面积:29.1 7.重原子数量:13 8.表面电荷:0 9.复杂度:175 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 |
| 风险声明 (欧洲) | 36/37/38 |
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| 安全声明 (欧洲) | S22-S24/25 |
| 海关编码 | 2924299090 |
| 海关编码 | 2924299090 |
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| 中文概述 | 2924299090. 其他环酰胺(包括环氨基甲酸酯)(包括其衍生物以及他们的盐). 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:30.0% |
| 申报要素 | 品名, 成分含量, 用途, 包装 |
| Summary | 2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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实验名称:High-throughput screen for inhibitors of the GIV GBA-motif interaction with Galpha-i ...
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id:HMS1303
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实验名称:A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id:HMS979
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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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实验名称:A screen for compounds that inhibit viral RNA polymerase binding and polymerization a...
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:Chain A, Poliovirus Polymerase With Gtp
External Id:HMS750
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| PhCONHC(CH3)3 |
| Benzamide,N-(1,1-dimethylethyl) |
| PhCONH(Me)3 |
| Benzamide,N-tert-butyl |
| N-tert-butyl benzamide |
| N-tert-butylcarbamoylbenzene |
| MFCD00041337 |
| N-tert-butyl-benzylamide |
| N-t-Butylbenzamide |
| 2,2-dimethyl-N-benzoylethylamine |