HCID60799243

2-(2-Bromophenyl)-1-(4-fluorophenyl)ethan-1-one

2-(2-bromophenyl)-1-(4-fluorophenyl)ethanone

C14H10BrFO293.13 g/molCAS 1127955-69-4

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IDENTITY

结构与身份

标准SMILES: O=C(Cc1ccccc1Br)c1ccc(F)cc1
InChIKey: QLBZBKCXNQPURE-UHFFFAOYSA-N
分子式: C14H10BrFO
平均分子量: 293.13 g/mol
单同位素质量: 291.98991

COMPUTED

结构计算性质

已同步

XLogP: 4
极性表面积: 17.1 Å²
氢键供体: 0
氢键受体: 2
可旋转键: 3
重原子: 17
形式电荷: 0
复杂度: 261

ALIASES

名称与别名

共 11 条

2-(2-bromophenyl)-1-(4-fluorophenyl)ethan-1-one1127955-69-42-(2-bromophenyl)-1-(4-fluorophenyl)ethanoneSCHEMBL1121619QLBZBKCXNQPURE-UHFFFAOYSA-N2-bromo-4'-fluorophenylacetophenoneCVB95569AKOS010016294CS-0234137EN300-138903Z513732910

REACTIONS

参与反应

2 条

uspto-grants-2006_08 · 10.6084/m9.figshare.5104873.v1 · US07094777B2

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

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