[2-(4-bromophenyl)-2-oxo-ethyl] benzoate结构式
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常用名 | [2-(4-bromophenyl)-2-oxo-ethyl] benzoate | 英文名 | [2-(4-bromophenyl)-2-oxo-ethyl] benzoate |
|---|---|---|---|---|
| CAS号 | 7506-12-9 | 分子量 | 319.15000 | |
| 密度 | 1.454g/cm3 | 沸点 | 461ºC at 760 mmHg | |
| 分子式 | C15H11BrO3 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 232.6ºC |
本表展示该化学物质的中文名称、英文系统名、各类中文与英文别名信息。
| 英文名 | [2-(4-bromophenyl)-2-oxoethyl] benzoate |
|---|---|
| 英文别名 | 更多 |
本表包含该物质理化参数,如熔点、沸点、密度、溶解度、旋光性等理化指标,无数据项标记为N/A。
| 密度 | 1.454g/cm3 |
|---|---|
| 沸点 | 461ºC at 760 mmHg |
| 分子式 | C15H11BrO3 |
| 分子量 | 319.15000 |
| 闪点 | 232.6ºC |
| 精确质量 | 317.98900 |
| PSA | 43.37000 |
| LogP | 3.48880 |
| InChIKey | VTEGMTYLKZOVGZ-UHFFFAOYSA-N |
| SMILES | O=C(COC(=O)c1ccccc1)c1ccc(Br)cc1 |
| 折射率 | 1.602 |
本表提供该化合物公开报道的合成路线、反应条件、反应物与产物参考信息。
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~98%
[2-(4-bromophen... 7506-12-9 |
| 文献:Bartsch, Richard A.; Phillips, John B. Synthetic Communications, 1986 , vol. 16, # 14 p. 1777 - 1780 |
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~88%
[2-(4-bromophen... 7506-12-9 |
| 文献:Miller, Jack M.; Brindle, Ian D.; Cater, Stephen R.; So, Kwok-Hung; Clark, James H. Analytical Chemistry, 1980 , vol. 52, # 14 p. 2430 - 2432 |
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~%
[2-(4-bromophen... 7506-12-9 |
| 文献:Erickson et al. Journal of the American Chemical Society, 1951 , vol. 73, p. 5301 |
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~%
[2-(4-bromophen... 7506-12-9 |
| 文献:Erickson et al. Journal of the American Chemical Society, 1951 , vol. 73, p. 5301 |
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~%
[2-(4-bromophen... 7506-12-9 |
| 文献:Srinivasan, C.; Shunmugasundaram, A.; Roja, M.; Arumugam, N. Indian Journal of Chemistry, Section B: Organic Chemistry Including Medicinal Chemistry, 1984 , vol. 23, # 6 p. 555 - 557 Title/Abstract Show Details Srinavasan, Chockalingam; Shunmugasundaram, Arunachalam; Arumugam, Natesan Journal of the Chemical Society, Perkin Transactions 2: Physical Organic Chemistry (1972-1999), 1985 , p. 17 - 20 |
本表列出该化学品对应的上游起始原料以及下游衍生产物清单。
| [2-(4-bromophenyl)-2-oxo-ethyl] benzoate上游产品 6 | |
|---|---|
| [2-(4-bromophenyl)-2-oxo-ethyl] benzoate下游产品 1 | |
本表记录该化合物靶点、体外体内实验、生物测定实验相关实验数据。
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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: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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本表罗列该化合物全部英文别名、系统命名、CAS别名等英文名称集合。
| HMS2499C24 |
| p-Bromophenacyl benzoate |
本部分为该化合物相关常见问答,包含基础参数、性状、储存条件等高频咨询问题与对应答案。
| Q: 7506-12-9的上游原料有哪些? |
| A: 7506-12-9相关上游原料(CAS):582-25-2;99-73-0;65-85-0;586-75-4;4203-30-9;532-32-1。 |
| Q: 7506-12-9的InChIKey是什么? |
| A: 7506-12-9InChIKey为VTEGMTYLKZOVGZ-UHFFFAOYSA-N。 |
| Q: 7506-12-9的中文名称是什么? |
| A: 7506-12-9的中文名称为7506-12-9。 |
| Q: 7506-12-9的CAS号是多少? |
| A: 7506-12-9CAS号为7506-12-9。 |
| Q: 7506-12-9的下游产品有哪些? |
| A: 7506-12-9相关下游产品(CAS):99-90-1。 |
| Q: 7506-12-9的分子量是多少? |
| A: 7506-12-9分子量为319.15000。 |
| Q: 7506-12-9的LogP(油水分配系数)是多少? |
| A: 7506-12-9LogP(油水分配系数)为3.48880。 |
| Q: 7506-12-9的分子式是什么? |
| A: 7506-12-9分子式为C15H11BrO3。 |
| Q: 7506-12-9的沸点是多少? |
| A: 7506-12-9沸点为461ºC at 760 mmHg。 |
| Q: 7506-12-9的极性表面积PSA是多少? |
| A: 7506-12-9极性表面积PSA为43.37000。 |