HCID15380360

Phenylmethyl 4-piperidineacetate

benzyl 2-piperidin-4-ylacetate

C14H19NO2233.31 g/molCAS 180182-05-2

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IDENTITY

结构与身份

标准SMILES: O=C(CC1CCNCC1)OCc1ccccc1
InChIKey: SINAXRLQVIULMJ-UHFFFAOYSA-N
分子式: C14H19NO2
平均分子量: 233.31 g/mol
单同位素质量: 233.14157885

COMPUTED

结构计算性质

已同步

XLogP: 1.9
极性表面积: 38.3 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 5
重原子: 17
形式电荷: 0
复杂度: 230

ALIASES

名称与别名

共 15 条

180182-05-2Phenylmethyl 4-piperidineacetateRefChem:369902Benzyl 2-(piperidin-4-yl)acetatebenzyl 2-(4-piperidyl)acetatebenzyl 2-piperidin-4-ylacetate4-piperidineacetic acid benzyl esterSCHEMBL7354989SCHEMBL8124713Benzyl (piperidin-4-yl)acetateSINAXRLQVIULMJ-UHFFFAOYSA-NDTXSID701302444MFCD24747828AKOS018165504A1-23889

REACTIONS

参与反应

3 条

uspto-grants-1999_02 · 10.6084/m9.figshare.5104873.v1 · US05866592

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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 (5/10) · 10.1039/C8SC04228D

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