HCID138276

4-Methoxy-3-methylphenylacetic acid

2-(4-methoxy-3-methylphenyl)acetic acid

C10H12O3180.2 g/molCAS 4513-73-9

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IDENTITY

结构与身份

标准SMILES: COc1ccc(CC(=O)O)cc1C
InChIKey: GYBWDAKGSPTODN-UHFFFAOYSA-N
分子式: C10H12O3
平均分子量: 180.2 g/mol
单同位素质量: 180.07864424

COMPUTED

结构计算性质

等待补全

XLogP: 1.9
极性表面积: 46.5 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 3
重原子: 13
形式电荷: 0
复杂度: 179

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 29 条

4-Methoxy-3-methylphenylacetic acid4513-73-9DTXSID80196399RefChem:99593DTXCID40118890GYBWDAKGSPTODN-UHFFFAOYSA-N2-(4-methoxy-3-methylphenyl)acetic acid(4-methoxy-3-methylphenyl)acetic acidMFCD00041034Benzeneacetic acid, 4-methoxy-3-methyl-(4-Methoxy-3-methyl-phenyl)-acetic acidSCHEMBL969758SCHEMBL300945393-methyl-4-methoxyphenylacetic acid4-Methoxy-3-methylbenzeneacetic acidCL8793SBB0106524-methoxy-3-methyl-phenylacetic acid4-Methoxy-3-methylphenyl acetic acidAKOS000302344

REACTIONS

参与反应

18 条

uspto-grants-2006_08 · 10.6084/m9.figshare.5104873.v1 · US07091237B2

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uspto-grants-2008_09 · 10.6084/m9.figshare.5104873.v1 · US07427635B2

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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-2011_05 · 10.6084/m9.figshare.5104873.v1 · US07951954B2

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Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (3/10) · 10.1039/C8SC04228D

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uspto-grants-2002_10 · 10.6084/m9.figshare.5104873.v1 · US06465687B1

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