HCID22728982

4-Methoxy-1-benzofuran-2-carboxylic acid

C10H8O4192.17 g/molCAS 50551-59-2

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IDENTITY

结构与身份

标准SMILES: COc1cccc2oc(C(=O)O)cc12
InChIKey: JDGOMFYYKYOPFZ-UHFFFAOYSA-N
分子式: C10H8O4
平均分子量: 192.17 g/mol
单同位素质量: 192.04225873

COMPUTED

结构计算性质

等待补全

XLogP: 2.2
极性表面积: 59.7 Å²
氢键供体: 1
氢键受体: 4
可旋转键: 2
重原子: 14
形式电荷: 0
复杂度: 228

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 20 条

50551-59-24-METHOXY-1-BENZOFURAN-2-CARBOXYLIC ACIDRefChem:524471103-271-44-methoxybenzofuran-2-carboxylic acidMFCD015464004-methoxy-2-Benzofurancarboxylic acidSCHEMBL913689JDGOMFYYKYOPFZ-UHFFFAOYSA-N4-methoxybenzofuran-2-carboxylicacidAKOS0227004454-Methoxy-benzofuran-2-carboxylic acidSB179494-methoxy-benzofuran-2-ylcarboxylic acid4-Methoxybenzo(b)furan-2-carboxylic acidDA-05390SY260343CS-0137460F14524F529575

REACTIONS

参与反应

10 条

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-2007_03 · 10.6084/m9.figshare.5104873.v1 · US07196199B2

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uspto-grants-2007_03 · 10.6084/m9.figshare.5104873.v1 · US07196199B2

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

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uspto-grants-2012_05 · 10.6084/m9.figshare.5104873.v1 · US08183366B2

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uspto-grants-2004_04 · 10.6084/m9.figshare.5104873.v1 · US06720320B2

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uspto-grants-2004_04 · 10.6084/m9.figshare.5104873.v1 · US06720320B2

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