N,N-Diethylaniline → 8-ethoxy-5,6-difluoro-3-(4-propylcyclohexyl)-3H-benzo[f]chromene

반응식

[C:40]([O:41][CH3:42])([CH3:43])([CH3:44])[CH3:45].[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][cH:6][c:7]2[cH:8][c:9]([O:16][CH:17]([C:18]#[CH:19])[CH:20]3[CH2:21][CH2:22][CH:23]([CH2:26][CH2:27][CH3:28])[CH2:24][CH2:25]3)[c:10]([F:15])[c:11]([F:14])[c:12]2[cH:13]1.[CH2:29]([N:30]([CH2:31][CH3:32])[c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1)[CH3:39]>>[CH2:1]([CH3:2])[O:3][c:4]1[cH:5][cH:6][c:7]2[c:8]3[c:9]([c:10]([F:15])[c:11]([F:14])[c:12]2[cH:13]1)[O:16][CH:17]([CH:20]1[CH2:21][CH2:22][CH:23]([CH2:26][CH2:27][CH3:28])[CH2:24][CH2:25]1)[CH:18]=[CH:19]3

참가 물질

반응물 3

HCID 7061N,N-Diethylaniline

HCID 15413tert-Butyl methyl ether

HCID 581518997-Ethoxy-1,2-difluoro-3-[1-(4-propylcyclohexyl)prop-2-ynyloxy]naphthalene

생성물 1

HCID 581518988-ethoxy-5,6-difluoro-3-(4-propylcyclohexyl)-3H-benzo[f]chromene

출처 및 근거

ORD 기록: ord-2de4cb9cec6544a9967d1981892faa78
출처 데이터셋: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

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