3,5-二甲基吡唑-4-甲酸乙酯结构式
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常用名 | 3,5-二甲基吡唑-4-甲酸乙酯 | 英文名 | Ethyl 3,5-Dimethylpyrazole-4-carboxylate |
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| CAS号 | 35691-93-1 | 分子量 | 168.19300 | |
| 密度 | 1.136g/cm3 | 沸点 | 284.8ºC at 760mmHg | |
| 分子式 | C8H12N2O2 | 熔点 | 66ºC | |
| MSDS | 美版 | 闪点 | 126ºC |
| 中文名 | 3,5-二甲基-1H-4-吡唑羧酸乙酯 |
|---|---|
| 英文名 | Ethyl 3,5-dimethyl-1H-pyrazole-4-carboxylate |
| 中文别名 | 3,5-二甲基吡唑-4-甲酸乙酯 |
| 英文别名 | 更多 |
| 密度 | 1.136g/cm3 |
|---|---|
| 沸点 | 284.8ºC at 760mmHg |
| 熔点 | 66ºC |
| 分子式 | C8H12N2O2 |
| 分子量 | 168.19300 |
| 闪点 | 126ºC |
| 精确质量 | 168.09000 |
| PSA | 54.98000 |
| LogP | 1.20320 |
| InChIKey | BCKARVLFIJPHQU-UHFFFAOYSA-N |
| SMILES | CCOC(=O)c1c(C)n[nH]c1C |
| 折射率 | 1.518 |
| 储存条件 | 室温,干燥 |
| 海关编码 | 2933199090 |
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~67%
3,5-二甲基吡唑-4-甲酸乙酯 35691-93-1 |
| 文献:H. LUNDBECK A/S; ESKILDSEN, Jørgen Patent: WO2014/49133 A1, 2014 ; Location in patent: Page/Page column 44 ; |
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~93%
3,5-二甲基吡唑-4-甲酸乙酯 35691-93-1 |
| 文献:Jung, Jae-Chul; Watkins, E.Blake; Avery, Mitchell A Tetrahedron, 2002 , vol. 58, # 18 p. 3639 - 3646 |
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~92%
3,5-二甲基吡唑-4-甲酸乙酯 35691-93-1 |
| 文献:Emelina, E. E.; Ermakov, N. V.; Ershov, B. A.; Zelenin, A. K. Russian Journal of Organic Chemistry, 1994 , vol. 30, # 10 p. 1637 - 1639 Zhurnal Organicheskoi Khimii, 1994 , vol. 30, # 10 p. 1554 - 1555 |
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~32%
3,5-二甲基吡唑-4-甲酸乙酯 35691-93-1 |
| 文献:Russian Journal of Organic Chemistry, , vol. 30, # 10 p. 1630 - 1636 Zhurnal Organicheskoi Khimii, , vol. 30, # 10 p. 1548 - 1553 |
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~%
3,5-二甲基吡唑-4-甲酸乙酯 35691-93-1 |
| 文献:Tetrahedron, , vol. 58, # 18 p. 3639 - 3646 |
|
~%
3,5-二甲基吡唑-4-甲酸乙酯 35691-93-1 |
| 文献:Justus Liebigs Annalen der Chemie, , vol. 279, p. 237 |
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~%
详细
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| 文献:Journal of the Indian Chemical Society, , vol. 7, p. 480 Chem. Zentralbl., , vol. 101, # II p. 3024 |
| 海关编码 | 2933199090 |
|---|---|
| 中文概述 | 2933199090. 其他结构上有非稠合吡唑环化合物. 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, 乌洛托品请注明外观, 6-己内酰胺请注明外观, 签约日期 |
| Summary | 2933199090. other compounds containing an unfused pyrazole ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
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实验名称:Phosphodiesterase (PDE) Inhibition Assay from Article 10.1038/nbt1059: "A family of p...
来源:BindingDB
靶标:N/A
External Id:BindingDB_1887_1
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实验名称:Discovery of Small Molecules to Inhibit Human Cytomegalovirus Nuclear Egress
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:HCMV UL50
External Id:HMS1262
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实验名称:Experimentally measured binding affinity data (IC50) for protein-ligand complexes der...
来源:Shanghai Institute of Organic Chemistry
靶标:N/A
External Id:PDBbind-IC50 for protein-ligand complexes
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实验名称:Inhibition of human His-tagged PDE4D catalytic domain expressed in Escherichia coli B...
来源:ChEMBL
靶标:cAMP-specific 3',5'-cyclic phosphodiesterase 4D
External Id:CHEMBL4425320
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实验名称:Rescue cell viability in cybrid cells with a genetic mutation in complex 1 of the mit...
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:N/A
External Id:HMS1315
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实验名称:MELAS cybrid survival enhancement under low glucose conditions
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
靶标:N/A
External Id:HMS1419
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| ethyl 3,5-dimethyl-1H-pyrazole-4-carboxylate |
| Ethyl 3,5-Dimethylpyrazole-4-carboxylate |