HCID13279434

2-(4-Hydroxyphenoxy)-1-(1,2-oxazolidin-2-yl)propan-1-one

C12H15NO4237.25 g/molCAS 87757-24-2

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IDENTITY

结构与身份

标准SMILES: CC(Oc1ccc(O)cc1)C(=O)N1CCCO1
InChIKey: YYWRAQDSZDUDFU-UHFFFAOYSA-N
分子式: C12H15NO4
平均分子量: 237.25 g/mol
单同位素质量: 237.10010796

COMPUTED

结构计算性质

已同步

XLogP: 1.6
极性表面积: 59 Å²
氢键供体: 1
氢键受体: 4
可旋转键: 3
重原子: 17
形式电荷: 0
复杂度: 263

ALIASES

名称与别名

共 7 条

87757-24-22-(4-Hydroxyphenoxy)-1-(isoxazolidin-2-yl)propan-1-one2-(4-Hydroxyphenoxy)-1-(1,2-oxazolidin-2-yl)propan-1-oneSCHEMBL11077985DTXSID10534265YYWRAQDSZDUDFU-UHFFFAOYSA-NN-[(+/-)-2-(4-hydroxyphenoxy)propionyl]isoxazolidine

REACTIONS

参与反应

7 条

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

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uspto-grants-1984_05 · 10.6084/m9.figshare.5104873.v1 · US04447259

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uspto-grants-1984_05 · 10.6084/m9.figshare.5104873.v1 · US04447259

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uspto-grants-1984_05 · 10.6084/m9.figshare.5104873.v1 · US04447259

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uspto-grants-1984_05 · 10.6084/m9.figshare.5104873.v1 · US04447259

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

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

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