HCID551577

Ethyl 2-aminopentanoate

C7H15NO2145.2 g/molCAS 13893-43-1

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IDENTITY

结构与身份

标准SMILES: CCCC(N)C(=O)OCC
InChIKey: DPBOUPADTRCCIH-UHFFFAOYSA-N
分子式: C7H15NO2
平均分子量: 145.2 g/mol
单同位素质量: 145.11027872

COMPUTED

结构计算性质

等待补全

XLogP: 0.9
极性表面积: 52.3 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 5
重原子: 10
形式电荷: 0
复杂度: 104

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 20 条

Ethyl 2-aminopentanoate13893-43-1DL-Norvaline, ethyl esterD-norvaline ethyl esterEthyl norvalinateEthyl DL-norvalinateO-Ethyl-DL-norvalineNorvaline, ethyl esterDL-Norvaline ethyl ester4XHK9HS7TKEthyl 2-aminopentanoate #SCHEMBL3195552SCHEMBL7527307SCHEMBL19056966SCHEMBL190569672-aminopentanoic acid ethyl esterDTXSID20930254Norvaline, ethyl ester, (.+/-.)-PD196057EN300-863844

REACTIONS

相关反应

6 条

Training data from https://doi.org/10.1039/C8SC04228D (8/10) · 10.1039/C8SC04228D

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uspto-grants-1999_12 · 10.6084/m9.figshare.5104873.v1 · US06004963

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uspto-grants-1999_12 · 10.6084/m9.figshare.5104873.v1 · US06004963

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Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

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

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