4-[2-(3-nitrophenyl)ethenyl]pyridine结构式
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常用名 | 4-[2-(3-nitrophenyl)ethenyl]pyridine | 英文名 | 4-[2-(3-nitrophenyl)ethenyl]pyridine |
|---|---|---|---|---|
| CAS号 | 46837-95-0 | 分子量 | 226.23100 | |
| 密度 | 1.273g/cm3 | 沸点 | 385.7ºC at 760 mmHg | |
| 分子式 | C13H10N2O2 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 187.1ºC |
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 | 4-[2-(3-nitrophenyl)ethenyl]pyridine |
|---|---|
| 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 | 1.273g/cm3 |
|---|---|
| 沸点 | 385.7ºC at 760 mmHg |
| 分子式 | C13H10N2O2 |
| 分子量 | 226.23100 |
| 闪点 | 187.1ºC |
| 精确质量 | 226.07400 |
| PSA | 58.71000 |
| LogP | 3.68340 |
| InChIKey | NGMZCGIDCNUHRJ-SNAWJCMRSA-N |
| SMILES | O=[N+]([O-])c1cccc(C=Cc2ccncc2)c1 |
| 折射率 | 1.694 |
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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~64%
4-[2-(3-nitroph... 46837-95-0 |
| 文献:Société Splicos; Centre National de la Recherche Scientifique; Institut Curie; Université de Montpellier 2 Patent: EP2505198 A1, 2012 ; Location in patent: Page/Page column 44 ; |
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~64%
4-[2-(3-nitroph... 46837-95-0 |
| 文献:Bramson; Holmes; Hunter; Lackey; Lovejoy; Luzzio; Montana; Rocque; Rusnak; Shewchuk; Veal; Corona; Walker; Kuyper; Davis; Dickerson; Edelstein; Frye; Gampe Jr.; Harris; Hassell Journal of Medicinal Chemistry, 2001 , vol. 44, # 25 p. 4339 - 4358 |
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~69%
4-[2-(3-nitroph... 46837-95-0 |
| 文献:Shi, Chuanli; Ding, Jinchang; Jiang, Jun; Chen, Jiuxi; Wu, Huayue; Liu, Miaochang Journal of Chemical Research, 2012 , vol. 36, # 6 p. 322 - 325 |
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~%
4-[2-(3-nitroph... 46837-95-0 |
| 文献:Wagstaff Journal of the Chemical Society, 1934 , p. 276 Full Text Show Details Horwitz Journal of Organic Chemistry, 1956 , vol. 21, p. 1039 Full Text View citing articles Show Details Michaillow; Ter-Sarkisjan Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, 1954 , p. 846,851;engl.Ausg. 731,735 |
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~%
4-[2-(3-nitroph... 46837-95-0 |
| 文献:Michaillow; Ter-Sarkisjan Izvestiya Akademii Nauk SSSR, Seriya Khimicheskaya, 1954 , p. 846,851;engl.Ausg. 731,735 |
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。
| 4-[2-(3-nitrophenyl)ethenyl]pyridine上游产品 7 | |
|---|---|
| 4-[2-(3-nitrophenyl)ethenyl]pyridine下游产品 2 | |
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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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。
| (E)-4-[2-(3-methylphenyl)ethenyl]phenol |
| (E)-4-(3-methylstyryl)phenol |
| 4-(3-Nitro-styryl)-pyridin |
| 4-(3-Nitro-trans-styryl)-pyridin |
| 4-(3-nitro-styryl)-pyridine |
| 4-(3-nitro-trans-styryl)-pyridine |
| (E)-4-[2-(3-nitrophenyl)vinyl]pyridine |
| 4-[(E)-2-(3-methylphenyl)ethenyl]phenol |
| (E)-4-(3-nitrostyryl)pyridine |
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: 46837-95-0的英文名称是什么? |
| A: 46837-95-0英文名称为4-[2-(3-nitrophenyl)ethenyl]pyridine。 |
| Q: 46837-95-0的InChIKey是什么? |
| A: 46837-95-0InChIKey为NGMZCGIDCNUHRJ-SNAWJCMRSA-N。 |
| Q: 46837-95-0的分子式是什么? |
| A: 46837-95-0分子式为C13H10N2O2。 |
| Q: 46837-95-0的上游原料有哪些? |
| A: 46837-95-0相关上游原料(CAS):100-43-6;585-79-5;645-00-1;13331-27-6;108-89-4;99-61-6;108-24-7。 |
| Q: 46837-95-0的LogP(油水分配系数)是多少? |
| A: 46837-95-0LogP(油水分配系数)为3.68340。 |
| Q: 46837-95-0的下游产品有哪些? |
| A: 46837-95-0相关下游产品(CAS):29714-08-7;32598-04-2。 |
| Q: 46837-95-0的极性表面积PSA是多少? |
| A: 46837-95-0极性表面积PSA为58.71000。 |
| Q: 46837-95-0的CAS号是多少? |
| A: 46837-95-0CAS号为46837-95-0。 |
| Q: 46837-95-0有哪些英文别名? |
| A: 46837-95-0英文别名有:(E)-4-[2-(3-methylphenyl)ethenyl]phenol、 (E)-4-(3-methylstyryl)phenol、 4-(3-Nitro-styryl)-pyridin、 4-(3-Nitro-trans-styryl)-pyridin、 4-(3-nitro-styryl)-pyridine、 4-(3-nitro-trans-styryl)-pyridine、 (E)-4-[2-(3-nitrophenyl)vinyl]pyridine、 4-[(E)-2-(3-methylphenyl)ethenyl]phenol、 (E)-4-(3-nitrostyryl)pyridine。 |
| Q: 46837-95-0的SMILES表达式是什么? |
| A: 46837-95-0SMILES表达式为O=[N+]([O-])c1cccc(C=Cc2ccncc2)c1。 |