HRID2096786

反应详情

EQUATION

反应方程式

REACTANTS

反应物

结构：CCN1C(=O)COc2ccc(C(O)(C(C)c3ccc(-c4ccc(Cl)c(C(=O)OC)c4)cc3Cl)C(F)(F)F)cc21

HCID67546541

未命名化合物

PRODUCTS

生成物

结构：CCN1C(=O)COc2ccc(C(O)(C(C)c3ccc(-c4ccc(Cl)c(C(=O)O)c4)cc3Cl)C(F)(F)F)cc21

HCID66697210

未命名化合物

AUXILIARIES

试剂、催化剂与溶剂

溶剂HCID8900

Heptane

C7H16

PROCEDURE

实验过程

In analogy to Example 56, step 6, 4,3′-Dichloro-4′-[2-(4-ethyl-3-oxo-3,4-dihydro-2H-benzo[1,4]oxazin-6-yl)-3,3,3-trifluoro-2-hydroxy-1-methyl-propyl]-biphenyl-3-carboxylic acid methyl ester was hydrolyzed (3 h, 65° C.). The product was treated with heptane for 17 h, filtered and dried to give the title compound as a white solid. MS (m/e, ISP neg. ion)=566.2 [M−H+].

WORKUP

后处理

custom(3 h, 65° C.)
filtrationfiltered
customdried

来源与证据

来源类型: Open Reaction Database
ORD 记录: ord-8ad4dc367f384237a187829cb601a662
来源数据集: uspto-grants-2013_05
DOI: 10.6084/m9.figshare.5104873.v1
专利: US08450313B2
来源说明: uspto-grants-2013_05

反应 SMILES

C[O:2][C:3]([C:5]1[CH:6]=[C:7]([C:12]2[CH:17]=[CH:16][C:15]([CH:18]([CH3:38])[C:19]([C:25]3[CH:26]=[CH:27][C:28]4[O:33][CH2:32][C:31](=[O:34])[N:30]([CH2:35][CH3:36])[C:29]=4[CH:37]=3)([OH:24])[C:20]([F:23])([F:22])[F:21])=[C:14]([Cl:39])[CH:13]=2)[CH:8]=[CH:9][C:10]=1[Cl:11])=[O:4]>CCCCCCC>[Cl:11][C:10]1[CH:9]=[CH:8][C:7]([C:12]2[CH:17]=[CH:16][C:15]([CH:18]([CH3:38])[C:19]([C:25]3[CH:26]=[CH:27][C:28]4[O:33][CH2:32][C:31](=[O:34])[N:30]([CH2:35][CH3:36])[C:29]=4[CH:37]=3)([OH:24])[C:20]([F:22])([F:21])[F:23])=[C:14]([Cl:39])[CH:13]=2)=[CH:6][C:5]=1[C:3]([OH:4])=[O:2]