HCID18314569

Ethyl 4-[(7,8-dihydro-8,8-dimethyl-5-(1-pentynyl)naphth-3-yl)ethynyl]benzoate

ethyl 4-[2-(5,5-dimethyl-8-pent-1-ynyl-6H-naphthalen-2-yl)ethynyl]benzoate

C28H28O2396.5 g/mol

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IDENTITY

结构与身份

标准SMILES: CCCC#CC1=CCC(C)(C)c2ccc(C#Cc3ccc(C(=O)OCC)cc3)cc21
InChIKey: FQEHNJGWJQKFCA-UHFFFAOYSA-N
分子式: C28H28O2
平均分子量: 396.5 g/mol
单同位素质量: 396.20893013

COMPUTED

结构计算性质

等待补全

XLogP: 7.4
极性表面积: 26.3 Å²
氢键供体: 0
氢键受体: 2
可旋转键: 7
重原子: 30
形式电荷: 0
复杂度: 766

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 4 条

SCHEMBL7633641FQEHNJGWJQKFCA-UHFFFAOYSA-NEthyl 4-[(7,8-dihydro-8,8-dimethyl-5-(1-pentynyl)-naphth-3-yl)ethynyl]benzoateethyl 4-[(7,8-dihydro-8,8-dimethyl-5-(1-pentynyl)naphth-3-yl)ethynyl]benzoate

REACTIONS

参与反应

14 条

uspto-grants-1997_07 · 10.6084/m9.figshare.5104873.v1 · US05648514

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uspto-grants-1997_07 · 10.6084/m9.figshare.5104873.v1 · US05648514

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uspto-grants-1997_07 · 10.6084/m9.figshare.5104873.v1 · US05648514

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uspto-grants-2002_03 · 10.6084/m9.figshare.5104873.v1 · US06355806B1

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uspto-grants-2002_03 · 10.6084/m9.figshare.5104873.v1 · US06355806B1

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uspto-grants-2002_03 · 10.6084/m9.figshare.5104873.v1 · US06355806B1

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uspto-grants-1999_12 · 10.6084/m9.figshare.5104873.v1 · US05998471

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uspto-grants-1999_12 · 10.6084/m9.figshare.5104873.v1 · US05998471

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