(3-oxocyclohexen-1-yl) benzoate结构式
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常用名 | (3-oxocyclohexen-1-yl) benzoate | 英文名 | (3-oxocyclohexen-1-yl) benzoate |
|---|---|---|---|---|
| CAS号 | 66049-39-6 | 分子量 | 216.23300 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C13H12O3 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
| 英文名 | (3-oxocyclohexen-1-yl) benzoate |
|---|---|
| 英文别名 | 更多 |
| 分子式 | C13H12O3 |
|---|---|
| 分子量 | 216.23300 |
| 精确质量 | 216.07900 |
| PSA | 43.37000 |
| LogP | 2.48030 |
| InChIKey | OBDRHMVLOOMVQK-UHFFFAOYSA-N |
| SMILES | O=C1C=C(OC(=O)c2ccccc2)CCC1 |
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~57%
(3-oxocyclohexe... 66049-39-6 |
| 文献:Shimoyama, Izumi; Zhang, Yantao; Wu, Guangzhong; Negishi, Ei-ichi Tetrahedron Letters, 1990 , vol. 31, # 20 p. 2841 - 2844 |
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~92%
(3-oxocyclohexe... 66049-39-6 |
| 文献:Isobe, Toshio; Ishikawa, Tsutomu Journal of Organic Chemistry, 1999 , vol. 64, # 19 p. 6984 - 6988 |
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~77%
(3-oxocyclohexe... 66049-39-6 |
| 文献:Vovk; Chubaruk; Bol'but Russian Journal of Organic Chemistry, 2004 , vol. 40, # 2 p. 280 - 281 |
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~%
(3-oxocyclohexe... 66049-39-6 |
| 文献:Akhrem,A.A. et al. Synthesis, 1978 , p. 925 - 927 |
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~%
(3-oxocyclohexe... 66049-39-6 |
| 文献:Katritzky, Alan R.; Pastor, Alfredo Journal of Organic Chemistry, 2000 , vol. 65, # 12 p. 3679 - 3681 |
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~%
(3-oxocyclohexe... 66049-39-6 |
| 文献:Mechoulam; Luchter; Goldblum Synthesis, 1974 , vol. No. 5, p. 363 - 364 |
| (3-oxocyclohexen-1-yl) benzoate上游产品 7 | |
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| (3-oxocyclohexen-1-yl) benzoate下游产品 2 | |
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实验名称:Concentration required to achieve 50% inhibition against 4-Hydroxyphenylpyruvate diox...
来源:ChEMBL
靶标:4-hydroxyphenylpyruvate dioxygenase
External Id:CHEMBL857062
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实验名称:Concentration required to achieve 50% inhibition against 4-Hydroxyphenylpyruvate diox...
来源:ChEMBL
靶标:4-hydroxyphenylpyruvate dioxygenase
External Id:CHEMBL615562
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实验名称:In vitro inhibitory activity against HPPD(4-hydroxyphenylpyruvate Dioxygenase) from p...
来源:ChEMBL
靶标:4-hydroxyphenylpyruvate dioxygenase
External Id:CHEMBL615563
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| 3-oxocyclohex-1-en-1-yl benzoate |
| 3-oxo-1-cyclohexen-1-yl benzoate |
| 3-benzoyloxycyclohex-2-enone |
| 3-Benzoyloxy-cyclohex-2-enon |
| 2-Cyclohexen-1-one,3-(benzoyloxy) |
| 3-benzoyloxy-2-cyclohexen-1-one |
| 3-Benzoyloxy-2-cyclohexenon |