1-溴-4-(苯磺酰基)苯结构式
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常用名 | 1-溴-4-(苯磺酰基)苯 | 英文名 | 1-Bromo-4-(phenylsulfonyl)benzene |
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| CAS号 | 23038-36-0 | 分子量 | 297.16800 | |
| 密度 | 1.531 g/cm3 | 沸点 | 418.5ºC at 760 mmHg | |
| 分子式 | C12H9BrO2S | 熔点 | 108-108.5 °C | |
| MSDS | N/A | 闪点 | 206.9ºC |
| 中文名 | 1-溴-4-(苯基磺酰基)苯 |
|---|---|
| 英文名 | 1-(benzenesulfonyl)-4-bromobenzene |
| 中文别名 | 1-溴-4-(苯磺酰基)苯 |
| 英文别名 | 更多 |
| 密度 | 1.531 g/cm3 |
|---|---|
| 沸点 | 418.5ºC at 760 mmHg |
| 熔点 | 108-108.5 °C |
| 分子式 | C12H9BrO2S |
| 分子量 | 297.16800 |
| 闪点 | 206.9ºC |
| 精确质量 | 295.95100 |
| PSA | 42.52000 |
| LogP | 4.36270 |
| InChIKey | WUQDRRXKNVIWIR-UHFFFAOYSA-N |
| SMILES | O=S(=O)(c1ccccc1)c1ccc(Br)cc1 |
| 外观性状 | 灰白色或白色粉末 |
| 蒸汽压 | 7.92E-07mmHg at 25°C |
| 折射率 | 1.618 |
| 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:42.5 7.重原子数量:16 8.表面电荷:0 9.复杂度:306 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 |
| 危害码 (欧洲) | Xi |
|---|---|
| 海关编码 | 2904909090 |
| 1-溴-4-(苯磺酰基)苯上游产品 10 | |
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| 1-溴-4-(苯磺酰基)苯下游产品 4 | |
| 海关编码 | 2904909090 |
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| 中文概述 | 2904909090 其他烃的磺化、硝化、亚硝化衍生物(不论是否卤化). 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:5.5% 普通关税:30.0% |
| 申报要素 | 品名, 成分含量, 用途 |
| Summary | HS:2904909090 sulphonated, nitrated or nitrosated derivatives of hydrocarbons, whether or not halogenated VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:5.5% 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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| 1-bromo-4-(phenylsulfonyl)benzene |
| p-Bromophenyl phenyl sulfone |
| Sulfone,p-bromophenyl phenyl |
| 4-Bromodiphenyl sulfone |
| 1-Bromo-4-(phenylsulphonyl)benzene |
| EINECS 245-392-6 |
| 4-Bromophenyl phenyl sulfone |
| 4-phenylsulfonylbromobenzene |
| benzene-p-sulphonylphenyl bromide |