HCID198261

Methyl 3-phenoxybenzoate

C14H12O3228.24 g/molCAS 50789-43-0

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IDENTITY

结构与身份

标准SMILES: COC(=O)c1cccc(Oc2ccccc2)c1
InChIKey: GWNMDCSPTJONPD-UHFFFAOYSA-N
分子式: C14H12O3
平均分子量: 228.24 g/mol
单同位素质量: 228.07864424

COMPUTED

结构计算性质

已同步

XLogP: 4.2
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: 17
形式电荷: 0
复杂度: 246

ALIASES

名称与别名

共 29 条

Methyl 3-phenoxybenzoate50789-43-0Benzoic acid, 3-phenoxy-, methyl esterDAU2SS7PEDDTXSID50198825RefChem:1089423DTXCID10121316256-764-2MFCD00017192Methyl-3-phenoxybenzoateEINECS 256-764-23-Methoxycarbonyldiphenyl etherBRN 2111581Benzoic acid,3-phenoxy-, methyl ester4-10-00-00320 (Beilstein Handbook Reference)SCHEMBL521860SCHEMBL2266392SCHEMBL5500091SBB053773AKOS022396915

REACTIONS

参与反应

3 条

uspto-grants-1992_10 · 10.6084/m9.figshare.5104873.v1 · US05152825

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uspto-grants-1991_01 · 10.6084/m9.figshare.5104873.v1 · US04988385

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Test data from https://doi.org/10.1039/C8SC04228D · 10.1039/C8SC04228D

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