HCID303593

6-(Trifluoroacetamido)hexanoic Acid

6-[(2,2,2-trifluoroacetyl)amino]hexanoic acid

C8H12F3NO3227.18 g/molCAS 407-91-0

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IDENTITY

结构与身份

标准SMILES: O=C(O)CCCCCNC(=O)C(F)(F)F
InChIKey: FGUZMCXMRNWZPT-UHFFFAOYSA-N
分子式: C8H12F3NO3
平均分子量: 227.18 g/mol
单同位素质量: 227.07692773

COMPUTED

结构计算性质

等待补全

XLogP: 1.2
极性表面积: 66.4 Å²
氢键供体: 2
氢键受体: 6
可旋转键: 6
重原子: 15
形式电荷: 0
复杂度: 228

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 19 条

407-91-06-(Trifluoroacetamido)hexanoic AcidDTXSID50307556RefChem:306957DTXCID802586836-(N-Trifluoroacetyl)aminocaproic Acid6-(2,2,2-TRIFLUOROACETAMIDO)HEXANOIC ACID6-[(2,2,2-trifluoroacetyl)amino]hexanoic acidMFCD00995559NSC192719Tfa-6-Ahx-OHN-(Trifluoroacetyl)-6-aminocaproic acidSCHEMBL14952606-trifluoroacetamidocaproic Acid6-Trifluoroacetamidohexanoic AcidNSC-1927196-(N-(trifluoroacetyl)amino)hexanoic acidEN300-932043H39873

REACTIONS

参与反应

4 条

uspto-grants-1991_11 · 10.6084/m9.figshare.5104873.v1 · US05068227

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Training data from https://doi.org/10.1039/C8SC04228D (1/10) · 10.1039/C8SC04228D

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uspto-grants-2006_05 · 10.6084/m9.figshare.5104873.v1 · US07049073B2

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uspto-grants-2013_05 · 10.6084/m9.figshare.5104873.v1 · US08450441B2

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