2,2,2-三氟-1-(1-甲基-1H-吲哚-3-基)乙醇结构式
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常用名 | 2,2,2-三氟-1-(1-甲基-1H-吲哚-3-基)乙醇 | 英文名 | 1-Methyl-3-(trifluoroacetyl)-1H-indole |
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| CAS号 | 318-54-7 | 分子量 | 227.18300 | |
| 密度 | 1.3g/cm3 | 沸点 | 299.8ºC at 760mmHg | |
| 分子式 | C11H8F3NO | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 135.1ºC |
| 中文名 | 1-甲基-3-(三氟乙酰基)-1H-吲哚 |
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| 英文名 | 2,2,2-trifluoro-1-(1-methylindol-3-yl)ethanone |
| 英文别名 | 更多 |
| 密度 | 1.3g/cm3 |
|---|---|
| 沸点 | 299.8ºC at 760mmHg |
| 分子式 | C11H8F3NO |
| 分子量 | 227.18300 |
| 闪点 | 135.1ºC |
| 精确质量 | 227.05600 |
| PSA | 22.00000 |
| LogP | 2.92330 |
| InChIKey | ICMIXFPYWFUAAL-UHFFFAOYSA-N |
| SMILES | Cn1cc(C(=O)C(F)(F)F)c2ccccc21 |
| 折射率 | 1.52 |
| 储存条件 | 室温 |
| 危害码 (欧洲) | Xi: Irritant; |
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| 海关编码 | 2933990090 |
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~82%
2,2,2-三氟-1-(1-甲... 318-54-7 |
| 文献:Hassinger, Heidi L.; Soll, Richard M.; Gribble, Gordon W. Tetrahedron Letters, 1998 , vol. 39, # 20 p. 3095 - 3098 |
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~%
2,2,2-三氟-1-(1-甲... 318-54-7 |
| 文献:Monsanto Company Patent: US5994270 A1, 1999 ; |
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~76%
2,2,2-三氟-1-(1-甲... 318-54-7 |
| 文献:Kiselyov, Alexander S. Tetrahedron Letters, 1995 , vol. 36, # 23 p. 4005 - 4008 |
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~%
2,2,2-三氟-1-(1-甲... 318-54-7 |
| 文献:Wang, Shuai; Nie, Jing; Zheng, Yan; Ma, Jun-An Organic Letters, 2014 , vol. 16, # 6 p. 1606 - 1609 |
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~%
2,2,2-三氟-1-(1-甲... 318-54-7 |
| 文献:Whalley Journal of the Chemical Society, 1954 , p. 1651 |
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~%
2,2,2-三氟-1-(1-甲... 318-54-7 |
| 文献:Whalley Journal of the Chemical Society, 1954 , p. 1651 |
| 2,2,2-三氟-1-(1-甲基-1H-吲哚-3-基)乙醇上游产品 6 | |
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| 2,2,2-三氟-1-(1-甲基-1H-吲哚-3-基)乙醇下游产品 1 | |
| 海关编码 | 2933990090 |
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| 中文概述 | 2933990090. 其他仅含氮杂原子的杂环化合物. 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 | 2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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实验名称:Primary cell-based high-throughput screening assay for identification of compounds th...
来源:Johns Hopkins Ion Channel Center
靶标:regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id:JHICC_RGS_Act_HTS
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实验名称:Luminescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id:OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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实验名称:QFRET-based biochemical primary high throughput screening assay to identify exosite i...
来源:The Scripps Research Institute Molecular Screening Center
靶标:disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id:ADAM17_INH_QFRET_1536_1X%INH PRUN
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实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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实验名称:uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
来源:Burnham Center for Chemical Genomics
靶标:N/A
External Id:BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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实验名称:High throughput fluorescence intensity-based biochemical assay to screen for small mo...
来源:University of Pittsburgh Molecular Library Screening Center
靶标:furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id:MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
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实验名称:Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
来源:Broad Institute
靶标:FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id:2147-01_Inhibitor_SinglePoint_HTS_Activity
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实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify pos...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_PAM_FLUO8_1536_1X%ACT PRUN
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实验名称:Fluorescence polarization-based biochemical high throughput primary assay to identify...
来源:The Scripps Research Institute Molecular Screening Center
靶标:RecName: Full=Sialate O-acetylesterase; AltName: Full=H-Lse; AltName: Full=Sialic acid-specific 9-O-acetylesterase; Flags: Precursor [Homo sapiens]
External Id:SIAE_INH_FP_1536_1X%INH PRUN
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实验名称:Absorbance-based primary biochemical high throughput screening assay to identify acti...
来源:The Scripps Research Institute Molecular Screening Center
靶标:caspase-3 preproprotein [Homo sapiens]
External Id:PROCASPASE3_ACT_EPIABS_1536_1X%ACT PRUN
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| 2,2,2-trifluoro-1-(1-methyl-indol-3-yl)-ethanone |
| 1-methyl-3-trifluoroacetyl-1H-indole |
| 2,2,2-trifluoro-1-(1-methyl-1H-indol-3-yl)ethanone |
| 2,2,2-Trifluor-1-(1-methyl-indol-3-yl)-aethanon |
| N-methyl-3-trifluoroacetylindole |
| HMS2306K13 |