HCID23081232

Tert-butyl 4-(4-hydroxybenzoyl)piperazine-1-carboxylate

C16H22N2O4306.36 g/molCAS 681482-86-0

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IDENTITY

结构与身份

标准SMILES: CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc(O)cc2)CC1
InChIKey: BRPBUWZNHVHHCX-UHFFFAOYSA-N
分子式: C16H22N2O4
平均分子量: 306.36 g/mol
单同位素质量: 306.15795719

COMPUTED

结构计算性质

已同步

XLogP: 1.7
极性表面积: 70.1 Å²
氢键供体: 1
氢键受体: 4
可旋转键: 3
重原子: 22
形式电荷: 0
复杂度: 403

ALIASES

名称与别名

共 16 条

tert-butyl 4-(4-hydroxybenzoyl)piperazine-1-carboxylate681482-86-0MFCD14635732t-Butyl 4-(4-hydroxybenzoyl)piperazine-1-carboxylateSCHEMBL5537347DTXSID10630377BRPBUWZNHVHHCX-UHFFFAOYSA-NGCB48286AB87011-Piperazinecarboxylic acid, 4-(4-hydroxybenzoyl)-, 1,1-dimethylethylesterAKOS026715432CS-0272858EN300-234772F539991tert-butyl4-(4-hydroxybenzoyl)piperazine-1-carboxylateF2145-0878

REACTIONS

参与反应

3 条

uspto-grants-2007_08 · 10.6084/m9.figshare.5104873.v1 · US07262212B2

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uspto-grants-2007_08 · 10.6084/m9.figshare.5104873.v1 · US07262212B2

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

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