HCID140282

Propiophenone, 4-bromo-2-hydroxy-

1-(4-bromo-2-hydroxyphenyl)propan-1-one

C9H9BrO2229.07 g/molCAS 17764-92-0

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IDENTITY

结构与身份

标准SMILES: CCC(=O)c1ccc(Br)cc1O
InChIKey: CPZPNEVIZAJTDT-UHFFFAOYSA-N
分子式: C9H9BrO2
平均分子量: 229.07 g/mol
单同位素质量: 227.97859

COMPUTED

结构计算性质

已同步

XLogP: 3.2
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: 12
形式电荷: 0
复杂度: 170

ALIASES

名称与别名

共 19 条

17764-92-0Propiophenone, 4-bromo-2-hydroxy-DTXSID80170356RefChem:375501DTXCID80928471-(4-bromo-2-hydroxyphenyl)propan-1-one1-(4-bromo-2-hydroxyphenyl)-1-propanone1-Propanone, 1-(4-bromo-2-hydroxyphenyl)-MFCD03791251SCHEMBL7534898SCHEMBL30863507CPZPNEVIZAJTDT-UHFFFAOYSA-NPropiophenone, 4-bromo-2-hydroxy-,SBB097396AKOS005071335Propiophenone, 4'-bromo-2'-hydroxy-1-(4-bromo-2-hydroxy-phenyl)-propan-1-oneCS-03184119T-0062

REACTIONS

参与反应

2 条

Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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uspto-grants-2000_01 · 10.6084/m9.figshare.5104873.v1 · US06011159

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