HCID776513

Ethyl 3-(4-methoxyphenyl)isoxazole-5-carboxylate

ethyl 3-(4-methoxyphenyl)-1,2-oxazole-5-carboxylate

C13H13NO4247.25 g/molCAS 376623-69-7

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IDENTITY

结构与身份

标准SMILES: CCOC(=O)c1cc(-c2ccc(OC)cc2)no1
InChIKey: FNEYQBSORYQAPC-UHFFFAOYSA-N
分子式: C13H13NO4
平均分子量: 247.25 g/mol
单同位素质量: 247.0844579

COMPUTED

结构计算性质

已同步

XLogP: 2.6
极性表面积: 61.6 Å²
氢键供体: 0
氢键受体: 5
可旋转键: 5
重原子: 18
形式电荷: 0
复杂度: 276

ALIASES

名称与别名

共 22 条

ethyl 3-(4-methoxyphenyl)isoxazole-5-carboxylate376623-69-7DTXSID40354574RefChem:343202DTXCID10305634ethyl 3-(4-methoxyphenyl)-1,2-oxazole-5-carboxylateOprea1_043416Oprea1_806544SCHEMBL11972337FNEYQBSORYQAPC-UHFFFAOYSA-N3-(4-Methoxy-phenyl)-isoxazole-5-carboxylic acid ethyl esterSBB014334STK786605AKOS000668918DS-2846DB-385187ST4134072CS-0166772ethyl3-(4-methoxyphenyl)isoxazole-5-carboxylateF304466

REACTIONS

参与反应

2 条

uspto-grants-2016_05 · 10.6084/m9.figshare.5104873.v1 · US09340506B2

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uspto-grants-2016_03 · 10.6084/m9.figshare.5104873.v1 · US09296711B2

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