HCID17860656

3,3-Dimethyl-1-(4-methylphenyl)butan-1-one

C13H18O190.28 g/molCAS 681215-86-1

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IDENTITY

结构与身份

标准SMILES: Cc1ccc(C(=O)CC(C)(C)C)cc1
InChIKey: SNOIQCMDEUVLSY-UHFFFAOYSA-N
分子式: C13H18O
平均分子量: 190.28 g/mol
单同位素质量: 190.13576519

COMPUTED

结构计算性质

等待补全

XLogP: 3.8
极性表面积: 17.1 Å²
氢键供体: 0
氢键受体: 1
可旋转键: 3
重原子: 14
形式电荷: 0
复杂度: 192

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 15 条

681215-86-13,3-Dimethyl-1-(4-methylphenyl)butan-1-oneDTXSID40591346RefChem:270343DTXCID805421104',3,3-TRIMETHYLBUTYROPHENONEMFCD038410763,3-dimethyl-1-(p-tolyl)butan-1-one3,3,4'-Trimethylbutyrophenone4-t-butylacetyltolueneSCHEMBL507049SNOIQCMDEUVLSY-UHFFFAOYSA-N3,3-dimethyl-1-p-tolylbutan-1-oneAKOS0093462933,3-Dimethyl-1-p-tolyl-butan-1-one

REACTIONS