5-[双(甲基硫代)亚甲基]-2,2-二甲基-1,3-二噁烷-4,6-二酮结构式
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常用名 | 5-[双(甲基硫代)亚甲基]-2,2-二甲基-1,3-二噁烷-4,6-二酮 | 英文名 | 5-(bis(methylthio)methylene)-2,2-dimethyl-1,3-dioxane-4,6-dione |
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| CAS号 | 100981-05-3 | 分子量 | 248.319 | |
| 密度 | 1.3±0.1 g/cm3 | 沸点 | 401.1±45.0 °C at 760 mmHg | |
| 分子式 | C9H12O4S2 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 202.6±16.7 °C |
| 中文名 | 5-[双(甲基硫代)亚甲基]-2,2-二甲基-1,3-二噁烷-4,6-二酮 |
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| 英文名 | 5-[bis(methylsulfanyl)methylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione |
| 英文别名 | 更多 |
| 密度 | 1.3±0.1 g/cm3 |
|---|---|
| 沸点 | 401.1±45.0 °C at 760 mmHg |
| 分子式 | C9H12O4S2 |
| 分子量 | 248.319 |
| 闪点 | 202.6±16.7 °C |
| 精确质量 | 248.017700 |
| PSA | 103.20000 |
| LogP | -0.29 |
| InChIKey | OCIGQKNRHXFMQJ-UHFFFAOYSA-N |
| SMILES | CSC(SC)=C1C(=O)OC(C)(C)OC1=O |
| 蒸汽压 | 0.0±0.9 mmHg at 25°C |
| 折射率 | 1.553 |
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~29%
5-[双(甲基硫代)亚甲基]-... 100981-05-3 |
| 文献:BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. Patent: WO2005/56562 A1, 2005 ; Location in patent: Page/Page column 79 ; WO 2005/056562 A1 |
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~%
5-[双(甲基硫代)亚甲基]-... 100981-05-3 |
| 文献:American Home Products Corporation Patent: US4547516 A1, 1985 ; |
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~49%
5-[双(甲基硫代)亚甲基]-... 100981-05-3 |
| 文献:Hunter, Gordon A.; McNab, Hamish Journal of the Chemical Society, Perkin Transactions 1: Organic and Bio-Organic Chemistry (1972-1999), 1995 , # 10 p. 1209 - 1214 |
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~%
5-[双(甲基硫代)亚甲基]-... 100981-05-3 |
| 文献:Huang, Xian; Chen, Bang-Chi Synthesis, 1986 , # 11 p. 967 - 968 |
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来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:HCMV UL50
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来源:NCGC
External Id:stopgo-p2-SytraCBC-dual-FF
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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
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来源:NCGC
External Id:stopgo-p2-SytraCBC-dual-Ren
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实验名称:Modulation of AMPAR-stargazin complexes
来源:Vanderbilt Screening Center for GPCRs, Ion Channels and Transporters
靶标:Stargazin (mouse)
External Id:WaveGuideAssay:441
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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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| 5-[Bis(methylsulfanyl)methylene]-2,2-dimethyl-1,3-dioxane-4,6-dione |
| 5-(bis(methylthio)methylene)-2,2-dimethyl-1,3-dioxane-4,6-dione |