4-Methylbenzaldehyde → Methyl 3-chloro-2-oxo-3-(p-tolyl)propanoate

반응식

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

참가 물질

반응물 3

HCID 77254-Methylbenzaldehyde

HCID 680234-Fluorobenzaldehyde

HCID 57437156Methyl 3-chloro-3-(4-fluorophenyl)-2-oxopropanoate

생성물 1

HCID 57437153Methyl 3-chloro-2-oxo-3-(p-tolyl)propanoate

출처 및 근거

ORD 기록: ord-c7aafb57cd65445dba35a2497eb4ee0e
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

반응 노트

불러오는 중…