HCID331870

N-(2-Hydroxy-1-benzylethyl)phthalimide

2-(1-hydroxy-3-phenylpropan-2-yl)isoindole-1,3-dione

C17H15NO3281.3 g/molCAS 93316-45-1

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IDENTITY

结构与身份

标准SMILES: O=C1c2ccccc2C(=O)N1C(CO)Cc1ccccc1
InChIKey: WUQQWFQBZMAJLS-UHFFFAOYSA-N
分子式: C17H15NO3
平均分子量: 281.3 g/mol
单同位素质量: 281.10519334

COMPUTED

结构计算性质

已同步

XLogP: 2.2
极性表面积: 57.6 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 4
重原子: 21
形式电荷: 0
复杂度: 379

ALIASES

名称与别名

共 11 条

N-(2-Hydroxy-1-benzylethyl)phthalimideNSC32693493316-45-1CBiol_000320SCHEMBL1237353DTXSID003181722-[(2S)-1-hydroxy-3-phenylpropan-2-yl]-2,3-dihydro-1H-isoindole-1,3-dioneICCB2_000320AKOS005142378NSC-3269342-(1-Hydroxy-3-phenylpropan-2-yl)-1H-isoindole-1,3(2H)-dione

REACTIONS

参与反应

3 条

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

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Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

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

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