Acetone → 4-(3,4-Difluorophenyl)-4-hydroxycyclohexanone

HRID 2139740

반응식

[CH3:20][C:21](=[O:22])[CH3:23].[ClH:24].[F:1][c:2]1[cH:3][c:4]([C:9]2([OH:19])[CH2:10][CH2:11][C:12]3([O:13][CH2:16][CH2:15][O:14]3)[CH2:17][CH2:18]2)[cH:5][cH:6][c:7]1[F:8]>>[F:1][c:2]1[cH:3][c:4]([C:9]2([OH:19])[CH2:10][CH2:11][C:12](=[O:13])[CH2:17][CH2:18]2)[cH:5][cH:6][c:7]1[F:8]

참가 물질

반응물 3

HCID 180Acetone

HCID 313Hydrochloric Acid

HCID 221221048-(3,4-Difluorophenyl)-1,4-dioxaspiro[4.5]decan-8-ol

생성물 1

HCID 221220904-(3,4-Difluorophenyl)-4-hydroxycyclohexanone

출처 및 근거

ORD 기록: ord-4ac4fcb727d84ea58a11d8be87f38fe7
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

연결된 노트

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