2-苄基-2-氰基-3-苯丙酸甲酯结构式
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常用名 | 2-苄基-2-氰基-3-苯丙酸甲酯 | 英文名 | Methyl 2-benzyl-2-cyano-3-phenylpropanoate |
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| CAS号 | 42550-72-1 | 分子量 | 279.33300 | |
| 密度 | 1.135g/cm3 | 沸点 | 445.7ºC at 760 mmHg | |
| 分子式 | C18H17NO2 | 熔点 | 57-60ºC | |
| MSDS | N/A | 闪点 | 221ºC |
| 中文名 | 2-苄基-2-氰基-3-苯丙酸甲酯 |
|---|---|
| 英文名 | Methyl 2-benzyl-2-cyano-3-phenylpropanoate |
| 英文别名 | 更多 |
| 密度 | 1.135g/cm3 |
|---|---|
| 沸点 | 445.7ºC at 760 mmHg |
| 熔点 | 57-60ºC |
| 分子式 | C18H17NO2 |
| 分子量 | 279.33300 |
| 闪点 | 221ºC |
| 精确质量 | 279.12600 |
| PSA | 50.09000 |
| LogP | 3.15478 |
| InChIKey | DIRZLMLPFWIGLB-UHFFFAOYSA-N |
| SMILES | COC(=O)C(C#N)(Cc1ccccc1)Cc1ccccc1 |
| 折射率 | 1.568 |
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~96%
2-苄基-2-氰基-3-苯丙酸甲酯 42550-72-1 |
| 文献:Hansen, Terkel; Alst, Tore; Havelkova, Martina; Strom, Morten B. Journal of Medicinal Chemistry, 2010 , vol. 53, # 2 p. 595 - 606 |
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~90%
2-苄基-2-氰基-3-苯丙酸甲酯 42550-72-1 |
| 文献:Calderon, Guillermo; Jaramillo-Gomez, Luz Marina; De La Torre, Jose M.; Cobo, Justo; Low, John N.; Glidewell, Christopher Acta Crystallographica Section C: Crystal Structure Communications, 2006 , vol. 62, # 9 p. o583-o586 |
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~%
2-苄基-2-氰基-3-苯丙酸甲酯 42550-72-1 |
| 文献:McElvain; Schroeder Journal of the American Chemical Society, 1949 , vol. 71, p. 47,52 |
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~%
2-苄基-2-氰基-3-苯丙酸甲酯 42550-72-1 |
| 文献:Hessler Journal of the American Chemical Society, 1916 , vol. 38, p. 911 |
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~%
2-苄基-2-氰基-3-苯丙酸甲酯 42550-72-1 |
| 文献:Hessler Journal of the American Chemical Society, 1916 , vol. 38, p. 911 |
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~%
2-苄基-2-氰基-3-苯丙酸甲酯 42550-72-1 |
| 文献:McElvain; Schroeder Journal of the American Chemical Society, 1949 , vol. 71, p. 47,52 |
| 2-苄基-2-氰基-3-苯丙酸甲酯上游产品 7 | |
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| 2-苄基-2-氰基-3-苯丙酸甲酯下游产品 0 | |
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实验名称:USP8 deubiquitinase inhibition: Primary qHTS
来源:24642
靶标:ubiquitin specific peptidase 8
External Id:USP8 FAST DUB HTS Primary
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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:USP17 deubiquitinase inhibition: Primary qHTS
来源:24642
靶标:ubiquitin specific peptidase 17 like family member 5
External Id:USP17 FAST DUB HTS Primary
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实验名称:USP7 deubiquitinase inhibition: Primary qHTS
来源:24642
靶标:ubiquitin specific peptidase 7
External Id:USP7 FAST DUB HTS Primary
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实验名称:A screen for compounds that inhibit the activity of LtaS in Staphylococcus aureus
来源:ICCB-Longwood/NSRB Screening Facility, Harvard Medical School
External Id:HMS979
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实验名称:Dicer-mediated maturation of pre-microRNA
来源:Center for Chemical Genomics, University of Michigan
靶标:N/A
External Id:TargetID_659_CEMA
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实验名称:USP28 deubiquitinase inhibition: Primary qHTS
来源:24642
靶标:ubiquitin specific peptidase 28
External Id:USP28 FAST DUB HTS Primary
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实验名称:USP10 deubiquitinase inhibition: Primary qHTS
来源:24642
靶标:ubiquitin specific peptidase 10
External Id:USP10 FAST DUB HTS Primary
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实验名称:Inhibitors of CDC25B-CDK2/CyclinA interaction
来源:Center for Chemical Genomics, University of Michigan
External Id:MScreen:TargetID_600
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实验名称:UCHL1 deubiquitinase inhibition: Primary qHTS
来源:24642
靶标:ubiquitin C-terminal hydrolase L1
External Id:UCHL1 FAST DUB HTS Primary
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| 2-benzyl-2-cyano-3-phenyl-propionic acid methyl ester |
| 2-Benzyl-2-cyan-3-phenyl-propionsaeure-methylester |
| Dibenzylcyanessigsaeuremethylester |
| HMS1446J13 |
| cyano-dibenzylacetic acid methyl ester |
| methyl dibenzyl-cyanoacetate |
| methylbenzylcyanophenylpropanoate |
| methyl 2-benzyl-2-cyano-3-phenylpropionate |