HCID608431

6-Ethoxy-2-phenylpyrimidin-4(3H)-one

4-ethoxy-2-phenyl-1H-pyrimidin-6-one

C12H12N2O2216.24 g/molCAS 42956-84-3

查看相关反应子结构检索查找相似结构

IDENTITY

结构与身份

标准SMILES: CCOc1cc(=O)[nH]c(-c2ccccc2)n1
InChIKey: PJTOQULKVMWVLW-UHFFFAOYSA-N
分子式: C12H12N2O2
平均分子量: 216.24 g/mol
单同位素质量: 216.08987763

COMPUTED

结构计算性质

已同步

XLogP: 1.5
极性表面积: 50.7 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 3
重原子: 16
形式电荷: 0
复杂度: 328

ALIASES

名称与别名

共 10 条

42956-84-3DTXSID903459726-Ethoxy-2-phenylpyrimidin-4(3H)-oneRefChem:308222DTXCID102970454(1H)-Pyrimidinone, 6-ethoxy-2-phenyl-6-Ethoxy-2-phenyl-4(H)-pyrimidinoneSCHEMBL86770476-ethoxy-2-phenyl-4(3H)-pyrimidinone6-Ethoxy-2-phenyl-4(1H)-pyrimidinone #

REACTIONS

相关反应

3 条

uspto-grants-1998_03 · 10.6084/m9.figshare.5104873.v1 · US05726124

查看

uspto-grants-1994_04 · 10.6084/m9.figshare.5104873.v1 · US05300477

查看

uspto-grants-1995_09 · 10.6084/m9.figshare.5104873.v1 · US05453414

查看