N-(苯并[d][1,3]二氧杂环戊烯-5-基)-2-氯乙酰胺结构式
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常用名 | N-(苯并[d][1,3]二氧杂环戊烯-5-基)-2-氯乙酰胺 | 英文名 | N-1,3-Benzodioxol-5-yl-2-chloroacetamide |
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| CAS号 | 227199-07-7 | 分子量 | 213.61800 | |
| 密度 | 1.472 g/cm3 | 沸点 | 399.5ºC at 760 mmHg | |
| 分子式 | C9H8ClNO3 | 熔点 | 155-156ºC | |
| MSDS | N/A | 闪点 | N/A |
| 中文名 | N-苯并[1,3]二氧五环-5-基-2-氯乙酰胺 |
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| 英文名 | N-(1,3-Benzodioxol-5-yl)-2-chloroacetamide |
| 中文别名 | N-1,3-苯并二氧代l-5-基-2-氯乙酰胺 |
| 英文别名 | 更多 |
| 密度 | 1.472 g/cm3 |
|---|---|
| 沸点 | 399.5ºC at 760 mmHg |
| 熔点 | 155-156ºC |
| 分子式 | C9H8ClNO3 |
| 分子量 | 213.61800 |
| 精确质量 | 213.01900 |
| PSA | 47.56000 |
| LogP | 1.66560 |
| InChIKey | HBIYZYYNHWRQMC-UHFFFAOYSA-N |
| SMILES | O=C(CCl)Nc1ccc2c(c1)OCO2 |
| 蒸汽压 | 1.36E-06mmHg at 25°C |
| 折射率 | 1.628 |
| 储存条件 | 室温 |
| 危害码 (欧洲) | Xi: Irritant; |
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| 海关编码 | 2932999099 |
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~74%
N-(苯并[d][1,3]二氧... 227199-07-7 |
| 文献:Baraldi, Pier Giovanni; Preti, Delia; Tabrizi, Mojgan Aghazadeh; Fruttarolo, Francesca; Saponaro, Giulia; Baraldi, Stefania; Romagnoli, Romeo; Moorman, Allan R.; Gessi, Stefania; Varani, Katia; Borea, Pier Andrea Bioorganic and Medicinal Chemistry, 2007 , vol. 15, # 7 p. 2514 - 2527 |
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~90%
N-(苯并[d][1,3]二氧... 227199-07-7 |
| 文献:Bhatia, Pramila A.; Daanen, Jerome F.; Hakeem, Ahmed A.; Kolasa, Teodozyj; Matulenko, Mark A.; Mortell, Kathleen H.; Patel, Meena V.; Stewart, Andrew O.; Wang, Xueqing; Xia, Zhiren; Zhang, Henry Q. Patent: US2004/29887 A1, 2004 ; |
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~%
N-(苯并[d][1,3]二氧... 227199-07-7 |
| 文献:Journal of the American Chemical Society, , vol. 41, p. 1457 |
| 上游产品 2 | |
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| 下游产品 0 | |
| 海关编码 | 2932999099 |
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| 中文概述 | 2932999099. 其他仅含氧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 |
| Summary | 2932999099. other heterocyclic compounds with oxygen 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:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfect...
来源:Broad Institute
靶标:N/A
External Id:Bursicon-induced LGR2 mediated cAMP production in LGR-2/CRE6x-Luciferase co-transfected HEK293 cells Inhibition - 7011-01_Antagonist_SinglePoint_HTS_Activity
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实验名称:NOVARTIS: Antimalarial liver stage activity measured as a greater than 50% reduction ...
来源:ChEMBL
靶标:Plasmodium yoelii
External Id:CHEMBL1789905
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| N-(1,3-benzodioxol-5-yl)-2-chloroacetamide |
| MFCD00245737 |