HCID22744595

Benzyl 4-fluoromethyl-4-hydroxy-1-piperidinecarboxylate

benzyl 4-(fluoromethyl)-4-hydroxypiperidine-1-carboxylate

C14H18FNO3267.3 g/molCAS 240400-86-6

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IDENTITY

结构与身份

标准SMILES: O=C(OCc1ccccc1)N1CCC(O)(CF)CC1
InChIKey: XPSUWCDOSZUMSO-UHFFFAOYSA-N
分子式: C14H18FNO3
平均分子量: 267.3 g/mol
单同位素质量: 267.1270716

COMPUTED

结构计算性质

等待补全

XLogP: 1.7
极性表面积: 49.8 Å²
氢键供体: 1
氢键受体: 4
可旋转键: 4
重原子: 19
形式电荷: 0
复杂度: 297

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 7 条

SCHEMBL6773206Benzyl 4-fluoromethyl-4-hydroxy-1-piperidinecarboxylateXPSUWCDOSZUMSO-UHFFFAOYSA-NDTXSID801175707240400-86-6benzyl 4-(fluoromethyl)-4-hydroxypiperidine-1-carboxylatePhenylmethyl 4-(fluoromethyl)-4-hydroxy-1-piperidinecarboxylate

REACTIONS

参与反应

3 条

uspto-grants-2004_03 · 10.6084/m9.figshare.5104873.v1 · US06699870B2

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

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uspto-grants-2002_12 · 10.6084/m9.figshare.5104873.v1 · US06498159B1

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