Benzene → 3-Chloro-1-(3-ethyl-1-methylcyclobutyl)prop-2-en-1-one

HRID 1208354

반응식

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

참가 물질

반응물 3

HCID 241Benzene

HCID 24386Thionyl Chloride

HCID 705764901-Hydroxy-3-(3-ethyl-1-methylcyclobutyl)-prop-1-en-3-one

생성물 1

HCID 545283223-Chloro-1-(3-ethyl-1-methylcyclobutyl)prop-2-en-1-one

출처 및 근거

ORD 기록: ord-54cec10c285e4a2380d1953eea498f06
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI: 10.1039/C8SC04228D

연결된 노트

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