HCID7537619

1-Methyl-5-phenyl-1H-pyrazole-3-carboxylic acid

1-methyl-5-phenylpyrazole-3-carboxylic acid

C11H10N2O2202.21 g/molCAS 10199-53-8

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IDENTITY

结构与身份

标准SMILES: Cn1nc(C(=O)O)cc1-c1ccccc1
InChIKey: ZDUDGEACIDDEPL-UHFFFAOYSA-N
分子式: C11H10N2O2
平均分子量: 202.21 g/mol
单同位素质量: 202.07422757

COMPUTED

结构计算性质

等待补全

XLogP: 1.8
极性表面积: 55.1 Å²
氢键供体: 1
氢键受体: 3
可旋转键: 2
重原子: 15
形式电荷: 0
复杂度: 239

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 26 条

10199-53-81-Methyl-5-phenyl-1H-pyrazole-3-carboxylic acidDTXSID60428766RefChem:231952DTXCID803796001-methyl-5-phenylpyrazole-3-carboxylic acid1H-Pyrazole-3-carboxylic acid, 1-methyl-5-phenyl-MFCD082719331-Methyl-5-phenyl pyrazole-3-carboxylic acid1-methyl-5-phenyl-pyrazole-3-carboxylic Acid1H-Pyrazole-3-carboxylicacid, 1-methyl-5-phenyl-SCHEMBL570061ZDUDGEACIDDEPL-UHFFFAOYSA-NKAA19953SBB092935AKOS000351098CS-W000419BS-14164SY128858DB-058745

REACTIONS

参与反应

6 条

Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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uspto-grants-2006_03 · 10.6084/m9.figshare.5104873.v1 · US07015218B1

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uspto-grants-2006_03 · 10.6084/m9.figshare.5104873.v1 · US07015218B1

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uspto-grants-2005_04 · 10.6084/m9.figshare.5104873.v1 · US06884821B1

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Training data from https://doi.org/10.1039/C8SC04228D (4/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (4/10) · 10.1039/C8SC04228D

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