HCID68490

alpha-Hydroxyacetophenone

2-hydroxy-1-phenylethanone

C8H8O2136.15 g/molCAS 582-24-1

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IDENTITY

结构与身份

标准SMILES: O=C(CO)c1ccccc1
InChIKey: ZWVHTXAYIKBMEE-UHFFFAOYSA-N
分子式: C8H8O2
平均分子量: 136.15 g/mol
单同位素质量: 136.05242949

COMPUTED

结构计算性质

等待补全

XLogP: 1.1
极性表面积: 37.3 Å²
氢键供体: 1
氢键受体: 2
可旋转键: 2
重原子: 10
形式电荷: 0
复杂度: 114

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 62 条

582-24-1Ethanone, 2-hydroxy-1-phenyl-alpha-HydroxyacetophenoneMethanol, benzoyl-Acetophenone, 2-hydroxy-omega-Hydroxyacetophenone1-Phenyl-2-hydroxyethanoneDQ1N9R01IADTXSID7060388RefChem:915524DTXCID90423382-Hydroxy-1-phenylethan-1-oneHydroxymethyl phenyl ketone(Hydroxyacetyl)benzene.alpha.-Hydroxyacetophenone.omega.-HydroxyacetophenoneMFCD000418292-Phenyl-2-oxoethanolNSC 171232Acetophenone, .alpha.-hydroxy-

REACTIONS

参与反应

197 条

uspto-grants-2006_08 · 10.6084/m9.figshare.5104873.v1 · US07087626B2

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uspto-grants-1979_04 · 10.6084/m9.figshare.5104873.v1 · US04150143

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uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09445606B2

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uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08841291B2

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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 (9/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 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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