Acetone → 4-(3-Chloro-4-cyclohexyl-phenyl)-2-butanone

반응식

[BH4-:1].[CH3:2][C:3](=[O:4])[CH3:5].[Cl:6][c:7]1[cH:8][c:9]([CH:19]=[CH:20][C:21]([CH3:22])=[O:23])[cH:10][cH:11][c:12]1[CH:13]1[CH2:14][CH2:15][CH2:16][CH2:17][CH2:18]1>>[Cl:6][c:7]1[cH:8][c:9]([CH2:19][CH2:20][C:21]([CH3:22])=[O:23])[cH:10][cH:11][c:12]1[CH:13]1[CH2:14][CH2:15][CH2:16][CH2:17][CH2:18]1

참가 물질

반응물 3

HCID 180Acetone

HCID 28123Borohydride

HCID 540831274-(3-Chloro-4-cyclohexylphenyl)but-3-en-2-one

생성물 1

HCID 215471084-(3-Chloro-4-cyclohexyl-phenyl)-2-butanone

출처 및 근거

ORD 기록: ord-8395f8e508224446ac638058f40431e5
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI: 10.1039/C8SC04228D

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