1-naphthalen-2-ylpentane-1,4-dione结构式
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常用名 | 1-naphthalen-2-ylpentane-1,4-dione | 英文名 | 1-naphthalen-2-ylpentane-1,4-dione |
|---|---|---|---|---|
| CAS号 | 123183-98-2 | 分子量 | 226.27000 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C15H14O2 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
摘要:1-萘并[2-甲基戊酸二酮的中文名称为1-萘并[2-甲基戊酸二酮,英文名称为1-naphthalen-2-ylpentane-1,4-dione,CAS号为123183-98-2,分子式为C15H14O2,分子量为226.27000。仅供科研实验参考,不作为医疗诊断与用药依据。
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 | 1-naphthalen-2-ylpentane-1,4-dione |
|---|---|
| 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。
| 分子式 | C15H14O2 |
|---|---|
| 分子量 | 226.27000 |
| 精确质量 | 226.09900 |
| PSA | 34.14000 |
| LogP | 3.39170 |
| InChIKey | LDLFCZYWHIIMJZ-UHFFFAOYSA-N |
| SMILES | CC(=O)CCC(=O)c1ccc2ccccc2c1 |
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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~88%
1-naphthalen-2-... 123183-98-2 |
| 文献:Smith, Martin D.; Jones, Christopher R.; Dan Panto, G.; Morrison, Angus J. Angewandte Chemie, International Edition, 2009 , vol. 48, # 40 p. 7391 - 7394 Angewandte Chemie, 2009 , vol. 120, # 40 p. 7527 - 7530 |
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~63%
1-naphthalen-2-... 123183-98-2 |
| 文献:Xue, Song; Li, Le-Zhen; Liu, Yong-Kang; Guo, Qing-Xiang Journal of Organic Chemistry, 2006 , vol. 71, # 1 p. 215 - 218 |
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~40%
1-naphthalen-2-... 123183-98-2 |
| 文献:Barluenga, Jose; Rodriguez, Felix; Fananas, Francisco J. Chemistry - A European Journal, 2000 , vol. 6, # 11 p. 1930 - 1937 |
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~55%
1-naphthalen-2-... 123183-98-2 |
| 文献:Roth, B. D.; Ortwine, D. F.; Hoefle, M. L.; Stratton, C. D.; Sliskovic, D. R.; et al. Journal of Medicinal Chemistry, 1990 , vol. 33, # 1 p. 21 - 31 |
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~%
1-naphthalen-2-... 123183-98-2 |
| 文献:Japan Tobacco Inc. Patent: EP885869 A1, 1998 ; |
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。
| 1-naphthalen-2-ylpentane-1,4-dione上游产品 9 | |
|---|---|
| 1-naphthalen-2-ylpentane-1,4-dione下游产品 0 | |
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。
| 1-(2-naphthyl)-1,4-pentanedione |
| 1,4-Pentanedione,1-(2-naphthalenyl) |
| 1-(naphthalen-2-yl)pentane-1,4-dione |
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: 123183-98-2的分子式是什么? |
| A: 123183-98-2分子式为C15H14O2。 |
| Q: 123183-98-2的上游原料有哪些? |
| A: 123183-98-2相关上游原料(CAS):78-95-5;93-08-3;13298-50-5;75-11-6;4541-70-2;78-94-4;4452-06-6;75-07-0;613-54-7。 |
| Q: 123183-98-2的SMILES表达式是什么? |
| A: 123183-98-2SMILES表达式为CC(=O)CCC(=O)c1ccc2ccccc2c1。 |
| Q: 123183-98-2的极性表面积PSA是多少? |
| A: 123183-98-2极性表面积PSA为34.14000。 |
| Q: 123183-98-2的LogP(油水分配系数)是多少? |
| A: 123183-98-2LogP(油水分配系数)为3.39170。 |
| Q: 123183-98-2的英文名称是什么? |
| A: 123183-98-2英文名称为1-naphthalen-2-ylpentane-1,4-dione。 |
| Q: 123183-98-2的CAS号是多少? |
| A: 123183-98-2CAS号为123183-98-2。 |
| Q: 123183-98-2有哪些英文别名? |
| A: 123183-98-2英文别名有:1-(2-naphthyl)-1,4-pentanedione、 1,4-Pentanedione,1-(2-naphthalenyl)、 1-(naphthalen-2-yl)pentane-1,4-dione。 |
| Q: 123183-98-2的中文名称是什么? |
| A: 123183-98-2的中文名称为123183-98-2。 |
| Q: 123183-98-2的InChIKey是什么? |
| A: 123183-98-2InChIKey为LDLFCZYWHIIMJZ-UHFFFAOYSA-N。 |