HCID164682

5-Fluorotryptamine

2-(5-fluoro-1H-indol-3-yl)ethanamine

C10H11FN2178.21 g/molCAS 576-16-9

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IDENTITY

结构与身份

标准SMILES: NCCc1c[nH]c2ccc(F)cc12
InChIKey: ZKIORVIXEWIOGB-UHFFFAOYSA-N
分子式: C10H11FN2
平均分子量: 178.21 g/mol
单同位素质量: 178.09062652

COMPUTED

结构计算性质

等待补全

XLogP: 0.7
极性表面积: 41.8 Å²
氢键供体: 2
氢键受体: 2
可旋转键: 2
重原子: 13
形式电荷: 0
复杂度: 174

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 52 条

5-Fluorotryptamine576-16-91H-Indole-3-ethanamine, 5-fluoro-AY99XA22FGDTXSID20206229RefChem:102668DTXCID70128720801-264-72-(5-fluoro-1H-indol-3-yl)ethanamine3-(2-Aminoethyl)-5-fluoro-1H-indole2-(5-FLUORO-1H-INDOL-3-YL)ETHAN-1-AMINEMFCD00797830CHEMBL2756282-(5-Fluoro-1H-indol-3-yl)-ethylamine2-(5-fluoroindol-3-yl)ethylamine2-(5-Fluoro-1H-indol-3-yl)ethylamineZKIORVIXEWIOGB-UHFFFAOYSA-N5-FLUORO-1H-INDOLE-3-ETHANAMINEChemDiv2_003993UNII-AY99XA22FG

REACTIONS

参与反应

24 条

uspto-grants-2016_09 · 10.6084/m9.figshare.5104873.v1 · US09434722B2

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

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uspto-grants-2001_10 · 10.6084/m9.figshare.5104873.v1 · US06306870B1

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

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uspto-grants-2016_03 · 10.6084/m9.figshare.5104873.v1 · US09284271B2

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

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

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uspto-grants-1996_12 · 10.6084/m9.figshare.5104873.v1 · US05580878

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