HCID118561

4-Butoxybenzoyl chloride

C11H13ClO2212.67 g/molCAS 33863-86-4

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IDENTITY

结构与身份

标准SMILES: CCCCOc1ccc(C(=O)Cl)cc1
InChIKey: KMGCTFHTBKBITO-UHFFFAOYSA-N
分子式: C11H13ClO2
平均分子量: 212.67 g/mol
单同位素质量: 212.0604073

COMPUTED

结构计算性质

等待补全

XLogP: 4.6
极性表面积: 26.3 Å²
氢键供体: 0
氢键受体: 2
可旋转键: 5
重原子: 14
形式电荷: 0
复杂度: 174

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 39 条

4-Butoxybenzoyl chloride33863-86-44-n-butoxybenzoyl chlorideBenzoyl chloride, 4-butoxy-p-Butoxybenzoyl chloride3K3Z5A9NPPEINECS 251-703-6DTXSID50187496BENZOYL CHLORIDE, P-BUTOXY-RefChem:98233DTXCID60109987251-703-6KMGCTFHTBKBITO-UHFFFAOYSA-N4-n-ButoxybenzoylchlorideMFCD000006894-Butoxy-benzoyl chloridep-butoxybenzoylchloride4-ButoxybenzoylchlorideUNII-3K3Z5A9NPP4-butyloxy benzoyl chloride

REACTIONS

相关反应

44 条

uspto-grants-1993_09 · 10.6084/m9.figshare.5104873.v1 · US05246948

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uspto-grants-2006_08 · 10.6084/m9.figshare.5104873.v1 · US07098234B2

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

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

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

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Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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uspto-grants-1995_02 · 10.6084/m9.figshare.5104873.v1 · US05389658

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uspto-grants-2002_03 · 10.6084/m9.figshare.5104873.v1 · US06352562B1

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