HCID11694825

4-(4-hydroxyphenyl)-3-(4-methoxyphenyl)furan-2(5H)-one

3-(4-hydroxyphenyl)-4-(4-methoxyphenyl)-2H-furan-5-one

C17H14O4282.29 g/mol

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IDENTITY

结构与身份

标准SMILES: COc1ccc(C2=C(c3ccc(O)cc3)COC2=O)cc1
InChIKey: PHSACMLAOJCVOQ-UHFFFAOYSA-N
分子式: C17H14O4
平均分子量: 282.29 g/mol
单同位素质量: 282.08920892

COMPUTED

结构计算性质

已同步

XLogP: 2.6
极性表面积: 55.8 Å²
氢键供体: 1
氢键受体: 4
可旋转键: 3
重原子: 21
形式电荷: 0
复杂度: 413

ALIASES

名称与别名

共 4 条

SCHEMBL1557659PHSACMLAOJCVOQ-UHFFFAOYSA-N4-(4-hydroxyphenyl)-3-(4-methoxyphenyl) furan-2(5H)-one4-(4-hydroxyphenyl)-3-(4-methoxyphenyl)furan-2(5H)-one

REACTIONS

参与反应

5 条

全部作为反应物作为生成物作为试剂作为催化剂作为溶剂

HRID90349

Training data from https://doi.org/10.1039/C8SC04228D (2/10)

作为反应物

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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HRID116766

Training data from https://doi.org/10.1039/C8SC04228D (2/10)

作为产物

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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HRID446811

uspto-grants-2013_07

作为产物

uspto-grants-2013_07 · 10.6084/m9.figshare.5104873.v1 · US08481534B2

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HRID446812

uspto-grants-2013_07

作为反应物

uspto-grants-2013_07 · 10.6084/m9.figshare.5104873.v1 · US08481534B2

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HRID446817

uspto-grants-2013_07

作为反应物

uspto-grants-2013_07 · 10.6084/m9.figshare.5104873.v1 · US08481534B2

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