HCID219150

4-Phenyl-1-(2H)-phthalazinone

4-phenyl-2H-phthalazin-1-one

C14H10N2O222.24 g/molCAS 5004-45-5

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IDENTITY

结构与身份

标准SMILES: O=c1[nH]nc(-c2ccccc2)c2ccccc12
InChIKey: XCJLBNVENUPHEA-UHFFFAOYSA-N
分子式: C14H10N2O
平均分子量: 222.24 g/mol
单同位素质量: 222.07931295

COMPUTED

结构计算性质

等待补全

XLogP: 2.7
极性表面积: 41.5 Å²
氢键供体: 1
氢键受体: 2
可旋转键: 1
重原子: 17
形式电荷: 0
复杂度: 331

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 59 条

4-Phenyl-1-(2H)-phthalazinoneRefChem:526322627-423-94-Phenylphthalazin-1(2H)-one5004-45-54-phenyl-1(2H)-phthalazinone4-Phenyl-2H-phthalazin-1-one1(2H)-Phthalazinone, 4-phenyl-4-phenyl-1,2-dihydrophthalazin-1-one4-phenyl-2-hydrophthalazin-1-one4-Phenylphthalazin-1-oneMFCD000982724-Phenyl-1[2H]-phthalazinone1-Hydroxy-4-phenylphthalazine4-Phenylbenzo(d4-phenyl phthalazinone4-phenylphthalazin-1-ol4-Phenyl-1-phthalazinolMaybridge1_003200TimTec1_001305

REACTIONS

参与反应

6 条

uspto-grants-2013_09 · 10.6084/m9.figshare.5104873.v1 · US08541428B2

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uspto-grants-1997_04 · 10.6084/m9.figshare.5104873.v1 · US05624922

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uspto-grants-2014_01 · 10.6084/m9.figshare.5104873.v1 · US08629143B2

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uspto-grants-1987_05 · 10.6084/m9.figshare.5104873.v1 · US04668677

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Training data from https://doi.org/10.1039/C8SC04228D (7/10) · 10.1039/C8SC04228D

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

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