HCID688432

(E)-5-(2-Carboxyvinyl)-2,4-dimethoxypyrimidine

(E)-3-(2,4-dimethoxypyrimidin-5-yl)prop-2-enoic acid

C9H10N2O4210.19 g/mol

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IDENTITY

结构与身份

标准SMILES: COc1ncc(/C=C/C(=O)O)c(OC)n1
InChIKey: MJGYRIKINWQSPO-ONEGZZNKSA-N
分子式: C9H10N2O4
平均分子量: 210.19 g/mol
单同位素质量: 210.0640568

COMPUTED

结构计算性质

已同步

XLogP: 0.8
极性表面积: 81.5 Å²
氢键供体: 1
氢键受体: 6
可旋转键: 4
重原子: 15
形式电荷: 0
复杂度: 244

ALIASES

名称与别名

共 10 条

119923-27-2(E)-3-(2,4-Dimethoxypyrimidin-5-yl)acrylic acid(E)-5-(2-Carboxyvinyl)-2,4-dimethoxypyrimidine(E)-3-(2,4-dimethoxypyrimidin-5-yl)prop-2-enoic acidE-5-(2-Carboxyvinyl)-2,4-dimethoxypyrimidineSCHEMBL3930316MJGYRIKINWQSPO-ONEGZZNKSA-NAKOS015908933F81472(E)-3-(2,4-Dimethoxypyrimidin-5-yl)acrylicacid

REACTIONS

参与反应

4 条

uspto-grants-1996_05 · 10.6084/m9.figshare.5104873.v1 · US05521163

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uspto-grants-1996_05 · 10.6084/m9.figshare.5104873.v1 · US05521163

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uspto-grants-1994_10 · 10.6084/m9.figshare.5104873.v1 · US05356882

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uspto-grants-1994_10 · 10.6084/m9.figshare.5104873.v1 · US05356882

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