Nitromethane → 4,4-Dimethyl-6,7-dimethoxy-1-bromomethylisochroman

HRID 120066

반응식

[Br:16][CH2:17][CH:18]=[O:19].[CH3:1][C:2]([CH2:3][OH:4])([c:5]1[cH:6][c:7]([O:13][CH3:14])[c:8]([O:11][CH3:12])[cH:9][cH:10]1)[CH3:15].[N+:20]([CH3:21])([O-:22])=[O:23]>>[CH3:1][C:2]1([CH3:15])[CH2:3][O:4][CH:18]([CH2:17][Br:16])[c:10]2[c:5]1[cH:6][c:7]([O:13][CH3:14])[c:8]([O:11][CH3:12])[cH:9]2

참가 물질

반응물 3

HCID 6375Nitromethane

HCID 105131Acetaldehyde, bromo-

HCID 130157782-(3,4-Dimethoxyphenyl)-2-methylpropan-1-ol

생성물 1

HCID 205230704,4-Dimethyl-6,7-dimethoxy-1-bromomethylisochroman

출처 및 근거

ORD 기록: ord-a39f6c690fd449d2bc42f5239e6e6e45
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

연결된 노트

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