HCID1491284

ethyl 1-(4-fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylate

ethyl 1-(4-fluorophenyl)-3,5-dimethylpyrazole-4-carboxylate

C14H15FN2O2262.28 g/molCAS 477710-46-6

查看相关反应子结构检索查找相似结构

IDENTITY

结构与身份

标准 SMILES: CCOC(=O)c1c(C)nn(-c2ccc(F)cc2)c1C
InChIKey: KRXPEHMOMPCHLF-UHFFFAOYSA-N
分子式: C14H15FN2O2
平均分子量: 262.28 g/mol
单同位素质量: 262.11175589

COMPUTED

结构计算性质

已同步

XLogP: 3
极性表面积: 44.1 Å²
氢键供体: 0
氢键受体: 4
可旋转键: 4
重原子: 19
形式电荷: 0
复杂度: 319

ALIASES

名称与别名

共 11 条

477710-46-6ethyl 1-(4-fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylateethyl 1-(4-fluorophenyl)-3,5-dimethylpyrazole-4-carboxylateMFCD02083006SCHEMBL6052477KRXPEHMOMPCHLF-UHFFFAOYSA-NDTXSID601175032AKOS0050836021R-0639ethyl 1-(4-fluorophenyl)-3,5-dimethyl-pyrazole-4-carboxylateethyl1-(4-fluorophenyl)-3,5-dimethyl-1H-pyrazole-4-carboxylate

REACTIONS