HCID69896

2-Propanone, 1-(3,4-dimethoxyphenyl)-

1-(3,4-dimethoxyphenyl)propan-2-one

C11H14O3194.23 g/molCAS 776-99-8

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IDENTITY

结构与身份

标准SMILES: COc1ccc(CC(C)=O)cc1OC
InChIKey: UMYZWICEDUEWIM-UHFFFAOYSA-N
分子式: C11H14O3
平均分子量: 194.23 g/mol
单同位素质量: 194.0942943

COMPUTED

结构计算性质

等待补全

XLogP: 1.1
极性表面积: 35.5 Å²
氢键供体: 0
氢键受体: 3
可旋转键: 4
重原子: 14
形式电荷: 0
复杂度: 191

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 49 条

3,4-Dimethoxyphenylacetone776-99-8(3,4-Dimethoxyphenyl)acetoneVeratryl acetone1-(3,4-Dimethoxyphenyl)-2-propanoneVeratryl-2-propanone1-(3,4-Dimethoxyphenyl)acetone3,4-Dimethoxybenzyl methyl ketone2-Propanone, 1-(3,4-dimethoxyphenyl)-DM28QN9QDYEINECS 212-285-0NSC 16700BRN 1107410NSC-16700DTXSID002282674-08-00-01844 (Beilstein Handbook Reference)RefChem:478554DTXCID20150758212-285-01-(3,4-dimethoxyphenyl)propan-2-one

REACTIONS

参与反应

34 条

uspto-grants-1993_09 · 10.6084/m9.figshare.5104873.v1 · US05245053

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uspto-grants-2006_08 · 10.6084/m9.figshare.5104873.v1 · US07083962B2

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

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

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Training data from https://doi.org/10.1039/C8SC04228D (6/10) · 10.1039/C8SC04228D

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uspto-grants-1987_02 · 10.6084/m9.figshare.5104873.v1 · US04642311

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uspto-grants-2001_04 · 10.6084/m9.figshare.5104873.v1 · US06221638B1

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uspto-grants-1984_04 · 10.6084/m9.figshare.5104873.v1 · US04440774

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