HCID524168

4-Tert-butyl-1-n-butylbenzene

1-butyl-4-tert-butylbenzene

C14H22190.32 g/molCAS 14011-00-8

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IDENTITY

结构与身份

标准SMILES: CCCCc1ccc(C(C)(C)C)cc1
InChIKey: BDSMPLDBKOVNHW-UHFFFAOYSA-N
分子式: C14H22
平均分子量: 190.32 g/mol
单同位素质量: 190.1721507

COMPUTED

结构计算性质

已同步

XLogP: 5.5
极性表面积: 0 Å²
氢键供体: 0
氢键受体: 0
可旋转键: 4
重原子: 14
形式电荷: 0
复杂度: 144

PROPERTIES

实验与物化性质

Kovats Retention Index

1345

1566.5；1559；1559

ALIASES

名称与别名

共 15 条

4-tert-butyl-1-n-butylbenzene14011-00-8DTXSID50335258RefChem:1071603DTXCID002863471-butyl-4-tert-butylbenzenet-butyl-4-butylbenzeneBenzene, 1-butyl-4-(1,1-dimethylethyl)1-t-butyl-4-n-butylbenzeneSCHEMBL547838SCHEMBL1611685SCHEMBL1611687SCHEMBL7711381SCHEMBL28488882N-(4-Methoxyphenyl)-N-methyl-2-(((2Z)-2-[1-(2-pyridinyl)ethylidene]hydrazino)carbothioyl)hydrazinecarbothioamide

REACTIONS

相关反应

4 条

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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uspto-grants-2003_05 · 10.6084/m9.figshare.5104873.v1 · US06562989B2

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uspto-grants-2003_05 · 10.6084/m9.figshare.5104873.v1 · US06562989B2

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Training data from https://doi.org/10.1039/C8SC04228D (5/10) · 10.1039/C8SC04228D

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