3H-Pyrazol-3-one,2,4-dihydro-5-methyl-2-phenyl-4-(phenylmethylene)
3H-Pyrazol-3-one,2,4-dihydro-5-methyl-2-phenyl-4-(phenylmethylene)结构式
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常用名 | 3H-Pyrazol-3-one,2,4-dihydro-5-methyl-2-phenyl-4-(phenylmethylene) | 英文名 | 3H-Pyrazol-3-one,2,4-dihydro-5-methyl-2-phenyl-4-(phenylmethylene) |
|---|---|---|---|---|
| CAS号 | 23901-60-2 | 分子量 | 262.30600 | |
| 密度 | 1.12g/cm3 | 沸点 | 404.4ºC at 760mmHg | |
| 分子式 | C17H14N2O | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 198.4ºC |
| 英文名 | (4Z)-4-benzylidene-5-methyl-2-phenylpyrazol-3-one |
|---|---|
| 英文别名 | 更多 |
| 密度 | 1.12g/cm3 |
|---|---|
| 沸点 | 404.4ºC at 760mmHg |
| 分子式 | C17H14N2O |
| 分子量 | 262.30600 |
| 闪点 | 198.4ºC |
| 精确质量 | 262.11100 |
| PSA | 32.67000 |
| LogP | 2.99330 |
| InChIKey | ZWJMMDQHGRHUCZ-VBKFSLOCSA-N |
| SMILES | CC1=NN(c2ccccc2)C(=O)C1=Cc1ccccc1 |
| 蒸汽压 | 9.48E-07mmHg at 25°C |
| 折射率 | 1.612 |
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~92%
3H-Pyrazol-3-on... 23901-60-2 |
| 文献：Sheibani, Hassan; Babaie, Maryam Synthetic Communications, 2010 , vol. 40, # 2 p. 257 - 265 |
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3H-Pyrazol-3-on... 23901-60-2 |
| 文献：Pavlenko, N. I.; Marshtupa, V. P.; Klyuev, N. A.; Baskunov, B. P. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1981 , vol. 17, # 8 p. 808 - 812 Khimiya Geterotsiklicheskikh Soedinenii, 1981 , # 8 p. 1088 - 1093 |
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~%
3H-Pyrazol-3-on... 23901-60-2 |
| 文献：Pavlenko, N. I.; Marshtupa, V. P.; Klyuev, N. A.; Baskunov, B. P. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1981 , vol. 17, # 8 p. 808 - 812 Khimiya Geterotsiklicheskikh Soedinenii, 1981 , # 8 p. 1088 - 1093 |
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~72%
3H-Pyrazol-3-on... 23901-60-2 |
| 文献：Hennig, Lothar; Alva-Astudillo, Mario; Mann, Gerhard; Kappe, Thomas Monatshefte fuer Chemie, 1992 , vol. 123, # 6 p. 571 - 580 |
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~41%
3H-Pyrazol-3-on... 23901-60-2 |
| 文献：Pavlenko, N. I.; Marshtupa, V. P.; Klyuev, N. A.; Baskunov, B. P. Chemistry of Heterocyclic Compounds (New York, NY, United States), 1981 , vol. 17, # 8 p. 808 - 812 Khimiya Geterotsiklicheskikh Soedinenii, 1981 , # 8 p. 1088 - 1093 |
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~%
3H-Pyrazol-3-on... 23901-60-2 |
| 文献：Ionescu Buletinul Societatii de Stiinte din Cluj, 1927 , vol. 3, p. 381 Chem. Zentralbl., 1928 , vol. 99, # I p. 695 |
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~%
3H-Pyrazol-3-on... 23901-60-2 |
| 文献：Li, Xiao-Liu; Wang, Yong-Mei; Tian, Bing; Matsuura, Teruo; Meng, Ji-Ben Journal of Heterocyclic Chemistry, 1998 , vol. 35, # 1 p. 129 - 134 |
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~%
3H-Pyrazol-3-on... 23901-60-2 |
| 文献：Knorr Justus Liebigs Annalen der Chemie, 1887 , vol. 238, p. 160,205 Justus Liebigs Annalen der Chemie, 1896 , vol. 293, p. 1,26, 41 |
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~%
3H-Pyrazol-3-on... 23901-60-2 |
| 文献：Betti Gazzetta Chimica Italiana, 1906 , vol. 36 II, p. 432 Gazzetta Chimica Italiana, 1907 , vol. 37 II, p. 98 |
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来源：DTP/NCI
靶标：N/A
External Id：MCF7_OneDose
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实验名称：NCI human tumor cell line growth inhibition assay. Data for the IGROV1 Non-Small Cell...
来源：DTP/NCI
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External Id：IGROV1_OneDose
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实验名称：Cell-based high throughput primary assay to identify activators of GPR151
来源：The Scripps Research Institute Molecular Screening Center
靶标：RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL
External Id：GPR151_PHUNTER_AG_LUMI_1536_1X%ACT
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实验名称：AlphaScreen-based biochemical high throughput primary assay to identify activators of...
来源：The Scripps Research Institute Molecular Screening Center
靶标：N/A
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来源：The Scripps Research Institute Molecular Screening Center
External Id：MITF_INH_Alpha_1536_1X%INH PRUN
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来源：ChEMBL
靶标：N/A
External Id：CHEMBL2174565
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来源：ChEMBL
靶标：N/A
External Id：CHEMBL2174563
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| 4-benzylidene-5-methyl-2-phenyl-2,3-dihydro-pyrazol-3-one |
| 3-methyl-1-phenyl-4-phenylidene-5-pyrazolone |
| 4-benzylidene-3-methyl-1-phenylpyrazolone |
| 4-benzylidene-1-phenyl-3-methyl-2-pyrazolin-5-one |
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