Propanedioic acid,2-[[[6-amino-2-(methylthio)-4-pyrimidinyl]amino]methylene]-, 1,3-diethyl ester结构式
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常用名 | Propanedioic acid,2-[[[6-amino-2-(methylthio)-4-pyrimidinyl]amino]methylene]-, 1,3-diethyl ester | 英文名 | Propanedioic acid,2-[[[6-amino-2-(methylthio)-4-pyrimidinyl]amino]methylene]-, 1,3-diethyl ester |
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| CAS号 | 36707-42-3 | 分子量 | 326.37100 | |
| 密度 | 1.31g/cm3 | 沸点 | 470.5ºC at 760mmHg | |
| 分子式 | C13H18N4O4S | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 238.3ºC |
| 英文名 | diethyl 2-[[(6-amino-2-methylsulfanylpyrimidin-4-yl)amino]methylidene]propanedioate |
|---|---|
| 英文别名 | 更多 |
| 密度 | 1.31g/cm3 |
|---|---|
| 沸点 | 470.5ºC at 760mmHg |
| 分子式 | C13H18N4O4S |
| 分子量 | 326.37100 |
| 闪点 | 238.3ºC |
| 精确质量 | 326.10500 |
| PSA | 141.73000 |
| LogP | 1.85690 |
| InChIKey | LPOCZNCNWDOCNI-UHFFFAOYSA-N |
| SMILES | CCOC(=O)C(=CNc1cc(N)nc(SC)n1)C(=O)OCC |
| 折射率 | 1.583 |
|
~69%
Propanedioic ac... 36707-42-3 |
| 文献:LYNDOR BIOSCIENCES L.L.C.; AKINSANMI, Lawrence; KINCAID, John Patent: WO2012/158197 A2, 2012 ; Location in patent: Page/Page column 104-105 ; |
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~84%
Propanedioic ac... 36707-42-3 |
| 文献:Anderson; Richardson Journal of Heterocyclic Chemistry, 1985 , vol. 22, # 6 p. 1735 - 1737 |
| Diethyl N-(2-methylthio-4-amino-6-pyrimidinyl)aminomethylenemalonate |
| diethyl-2(6-amino-2-(methylthio)pyrimidin-4-ylamino)methylenemalonate |
| [(6-amino-2-methylsulfanyl-pyrimidin-4-ylamino)-methylene]-malonic acid diethyl ester |
| diethyl 2-(((6-amino-2-(methylsulfanyl)-4-pyrimidinyl)amino)methylene)malonate |