HCID66778158

Cyclohexyl(6-methoxy-2-methyl-1-benzofuran-3-yl)methanone

cyclohexyl-(6-methoxy-2-methyl-1-benzofuran-3-yl)methanone

C17H20O3272.34 g/mol

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IDENTITY

结构与身份

标准SMILES: COc1ccc2c(C(=O)C3CCCCC3)c(C)oc2c1
InChIKey: CPSKJYAPFCQJAG-UHFFFAOYSA-N
分子式: C17H20O3
平均分子量: 272.34 g/mol
单同位素质量: 272.1412445

COMPUTED

结构计算性质

扩展信息补全中

XLogP: 4.5
极性表面积: 39.4 Å²
氢键供体: 0
氢键受体: 3
可旋转键: 3
重原子: 20
形式电荷: 0
复杂度: 348

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 6 条

SCHEMBL719422CPSKJYAPFCQJAG-UHFFFAOYSA-NDB-197977Cyclohexyl(6-methoxy-2-methyl-3-benzofuranyl)methanonecyclohexyl(6-methoxy-2-methyl-1-benzofuran-3-yl)methanone1186544-42-2

REACTIONS

参与反应

4 条

Training data from https://doi.org/10.1039/C8SC04228D (1/10) · 10.1039/C8SC04228D

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uspto-grants-2013_05 · 10.6084/m9.figshare.5104873.v1 · US08436043B2

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uspto-grants-2013_05 · 10.6084/m9.figshare.5104873.v1 · US08436043B2

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Training data from https://doi.org/10.1039/C8SC04228D (4/10) · 10.1039/C8SC04228D

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