1-(Bromomethyl)-2-chloro-4-fluorobenzene → 1-(2-Chloro-4-fluorobenzyl)-2-cyclohexyl-4,4-dimethyl-1,2-diazetidin-3-one

반응식

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

참가 물질

반응물 2

HCID 27250621-(Bromomethyl)-2-chloro-4-fluorobenzene

HCID 673030222-Cyclohexyl-4,4-dimethyl-1,2-diazetidin-3-one

생성물 1

HCID 593615061-(2-Chloro-4-fluorobenzyl)-2-cyclohexyl-4,4-dimethyl-1,2-diazetidin-3-one

출처 및 근거

ORD 기록: ord-69f84ab0ffe64b439a7f5f1e46acac6d
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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