HRID1631906

反应详情

EQUATION

反应方程式

REACTANTS

反应物

HCID162099

1-cyclohexylbutane-1,3-dione

C10H16O2

HCID7131483

methyl (3,5-dimethyl-1H-pyrazol-4-yl)acetate

C8H12N2O2

HCID66707366

未命名化合物

HCID66707369

未命名化合物

结构：COC(=O)Cc1c(C)nn(Cc2ccc([N+](=O)[O-])cc2)c1C

HCID66707610

未命名化合物

PRODUCTS

生成物

结构：Cc1c(CC(=O)OC(C)(C)C)c(C2CCCCC2)nn1Cc1ccc([N+](=O)[O-])cc1

HCID66707492

未命名化合物

PROCEDURE

实验过程

[3-Cyclohexyl-5-methyl-1-(4-nitro-benzyl)-1H-pyrazol-4-yl]-acetic acid tert-butyl ester was prepared according to the preparation of intermediate 1.1.2, using in the alkylation reaction (3-cyclohexyl-5-methyl-1H-pyrazol-4-yl)-acetic acid tert-butyl ester (preparation according to the preparation of (3,5-diethyl-1H-pyrazol-4-yl)-acetic acid tert-butyl ester, WO2007/141267, employing 1-cyclohexyl-butane-1,3-dione instead of heptane-3,5-dione) instead of (3,5-dimethyl-1H-pyrazol-4-yl)-acetic acid methyl ester.

WORKUP

后处理

custompreparation

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-076969497d65413cab5b2714201e934b
来源数据集: uspto-grants-2014_07
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08791272B2
来源说明: uspto-grants-2014_07

反应 SMILES

COC(=O)CC1C(C)=NN([CH2:11][C:12]2[CH:17]=[CH:16][C:15]([N+:18]([O-:20])=[O:19])=[CH:14][CH:13]=2)C=1C.[C:23]([O:27][C:28](=[O:42])[CH2:29][C:30]1[C:31]([CH:36]2[CH2:41][CH2:40][CH2:39][CH2:38][CH2:37]2)=[N:32][NH:33][C:34]=1[CH3:35])([CH3:26])([CH3:25])[CH3:24].C(OC(=O)CC1C(CC)=NNC=1CC)(C)(C)C.C1(C(=O)CC(=O)C)CCCCC1.COC(=O)CC1C(C)=NNC=1C>>[C:23]([O:27][C:28](=[O:42])[CH2:29][C:30]1[C:31]([CH:36]2[CH2:41][CH2:40][CH2:39][CH2:38][CH2:37]2)=[N:32][N:33]([CH2:11][C:12]2[CH:17]=[CH:16][C:15]([N+:18]([O-:20])=[O:19])=[CH:14][CH:13]=2)[C:34]=1[CH3:35])([CH3:26])([CH3:24])[CH3:25]