HCID20312394

N-t-butoxycarbonyl-2-(4-hydroxyphenyl)glycine n-butyl ester

butyl 2-(4-hydroxyphenyl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]acetate

C17H25NO5323.4 g/mol

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IDENTITY

结构与身份

标准SMILES: CCCCOC(=O)C(NC(=O)OC(C)(C)C)c1ccc(O)cc1
InChIKey: HFDGKLCUGOEPEV-UHFFFAOYSA-N
分子式: C17H25NO5
平均分子量: 323.4 g/mol
单同位素质量: 323.1732729

COMPUTED

结构计算性质

已同步

XLogP: 3.4
极性表面积: 84.9 Å²
氢键供体: 2
氢键受体: 5
可旋转键: 9
重原子: 23
形式电荷: 0
复杂度: 383

ALIASES

名称与别名

共 4 条

SCHEMBL11638205HFDGKLCUGOEPEV-UHFFFAOYSA-NN-t-butoxycarbonyl-2-(4-hydroxyphenyl)glycine n-butyl esterN-t-butoxycarbonyl-2-(4-hydroxyphenyl)-glycine n-butyl ester

REACTIONS

参与反应

7 条

Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D

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uspto-grants-1976_11 · 10.6084/m9.figshare.5104873.v1 · US03994954

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uspto-grants-1976_11 · 10.6084/m9.figshare.5104873.v1 · US03994954

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uspto-grants-1976_12 · 10.6084/m9.figshare.5104873.v1 · US03997584

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uspto-grants-1976_12 · 10.6084/m9.figshare.5104873.v1 · US03997584

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uspto-grants-1978_08 · 10.6084/m9.figshare.5104873.v1 · US04108854

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uspto-grants-1978_08 · 10.6084/m9.figshare.5104873.v1 · US04108854

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