diethyl 2,6-dimethyl-4-pyridin-3-yl-pyridine-3,5-dicarboxylate结构式
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常用名 | diethyl 2,6-dimethyl-4-pyridin-3-yl-pyridine-3,5-dicarboxylate | 英文名 | diethyl 2,6-dimethyl-4-pyridin-3-yl-pyridine-3,5-dicarboxylate |
|---|---|---|---|---|
| CAS号 | 54756-41-1 | 分子量 | 328.36200 | |
| 密度 | 1.162g/cm3 | 沸点 | 433.9ºC at 760 mmHg | |
| 分子式 | C18H20N2O4 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 216.2ºC |
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 | diethyl 2,6-dimethyl-4-pyridin-3-ylpyridine-3,5-dicarboxylate |
|---|---|
| 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 | 1.162g/cm3 |
|---|---|
| 沸点 | 433.9ºC at 760 mmHg |
| 分子式 | C18H20N2O4 |
| 分子量 | 328.36200 |
| 闪点 | 216.2ºC |
| 精确质量 | 328.14200 |
| PSA | 78.38000 |
| LogP | 3.11380 |
| InChIKey | MYIRWARHQKMZDP-UHFFFAOYSA-N |
| SMILES | CCOC(=O)c1c(C)nc(C)c(C(=O)OCC)c1-c1cccnc1 |
| 折射率 | 1.546 |
本表记录该化合物安全警示、防护措施、禁配物、处置方式等安全相关参考信息。
| 海关编码 | 2933399090 |
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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。
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。
| 上游产品 3 | |
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| 下游产品 1 | |
本表展示该化学品海关编码、关税、监管条件等进出口海关参考数据。
| 海关编码 | 2933399090 |
|---|---|
| 中文概述 | 2933399090. 其他结构含非稠合吡啶环的化合物. 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 | 2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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:Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ...
来源:ChEMBL
靶标:Klebsiella pneumoniae
External Id:CHEMBL4296186
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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:Identifying Sarm1 TIR NADase inhibitors through high throughput HPLC assay
来源:24386
靶标:N/A
External Id:Sarm1 TIR NADase inhibitors
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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。
| diethyl 2,6-dimethyl-4-(3-pyridyl)pyridine-3,5-dicarboxylate |
| HMS2884D03 |
| 2',6'-Dimethyl-[3,4']bipyridyl-3',5'-dicarbonsaeure-diaethylester |
| 2',6'-dimethyl-[3,4']bipyridyl-3',5'-dicarboxylic acid diethyl ester |
| 2',6'-dimethyl-[3,4']bipyridinyl-3',5'-dicarboxylic acid diethyl ester |
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: 54756-41-1的SMILES表达式是什么? |
| A: 54756-41-1SMILES表达式为CCOC(=O)c1c(C)nc(C)c(C(=O)OCC)c1-c1cccnc1。 |
| Q: 54756-41-1的英文名称是什么? |
| A: 54756-41-1英文名称为diethyl 2,6-dimethyl-4-pyridin-3-ylpyridine-3,5-dicarboxylate。 |
| Q: 54756-41-1的极性表面积PSA是多少? |
| A: 54756-41-1极性表面积PSA为78.38000。 |
| Q: 54756-41-1的中文名称是什么? |
| A: 54756-41-1的中文名称为54756-41-1。 |
| Q: 54756-41-1有哪些英文别名? |
| A: 54756-41-1英文别名有:diethyl 2,6-dimethyl-4-(3-pyridyl)pyridine-3,5-dicarboxylate、 HMS2884D03、 2',6'-Dimethyl-[3,4']bipyridyl-3',5'-dicarbonsaeure-diaethylester、 2',6'-dimethyl-[3,4']bipyridyl-3',5'-dicarboxylic acid diethyl ester、 2',6'-dimethyl-[3,4']bipyridinyl-3',5'-dicarboxylic acid diethyl ester。 |
| Q: 54756-41-1的分子式是什么? |
| A: 54756-41-1分子式为C18H20N2O4。 |
| Q: 54756-41-1的沸点是多少? |
| A: 54756-41-1沸点为433.9ºC at 760 mmHg。 |
| Q: 54756-41-1的上游原料有哪些? |
| A: 54756-41-1相关上游原料(CAS):23125-30-6;500-22-1;141-97-9。 |
| Q: 54756-41-1的CAS号是多少? |
| A: 54756-41-1CAS号为54756-41-1。 |
| Q: 54756-41-1的InChIKey是什么? |
| A: 54756-41-1InChIKey为MYIRWARHQKMZDP-UHFFFAOYSA-N。 |