Diethyl Ether → 2-[4-(4-Chlorophenyl)phenyl]-5-ethyl-5-phenyl-1,3-dioxolan-4-one

반응식

[CH3:29][CH2:30][O:31][CH2:32][CH3:33].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([CH:12]=[O:13])[cH:14][cH:15]2)[cH:6][cH:7]1.[OH:16][C:17]([C:18](=[O:19])[OH:20])([CH2:21][CH3:22])[c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([CH:12]3[O:13][C:17]([CH2:21][CH3:22])([c:23]4[cH:24][cH:25][cH:26][cH:27][cH:28]4)[C:18](=[O:19])[O:20]3)[cH:14][cH:15]2)[cH:6][cH:7]1

참가 물질

반응물 3

HCID 3283Diethyl Ether

HCID 2873222-Hydroxy-2-phenylbutanoic acid

HCID 5925704'-Chloro[1,1'-biphenyl]-4-carbaldehyde

생성물 1

HCID 127737622-[4-(4-Chlorophenyl)phenyl]-5-ethyl-5-phenyl-1,3-dioxolan-4-one

출처 및 근거

ORD 기록: ord-1adc9e6e724941a0a070df8f8c77e8dd
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

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