Dichloromethane → 2-Amino-1-[5-[4-(trifluoromethoxy)phenyl]-1,3,4-oxadiazol-2-yl]butan-1-ol

반응식

[C:1]([O:2][C:3](=[O:4])[NH:7][CH:8]([CH2:9][CH3:10])[CH:11]([c:12]1[o:13][c:14](-[c:17]2[cH:18][cH:19][c:20]([O:23][C:24]([F:25])([F:26])[F:27])[cH:21][cH:22]2)[n:15][n:16]1)[OH:28])([CH3:5])([CH3:6])[CH3:29].[Cl:37][CH2:38][Cl:39].[OH:30][C:31]([C:32]([F:33])([F:34])[F:35])=[O:36]>>[NH2:7][CH:8]([CH2:9][CH3:10])[CH:11]([c:12]1[o:13][c:14](-[c:17]2[cH:18][cH:19][c:20]([O:23][C:24]([F:25])([F:26])[F:27])[cH:21][cH:22]2)[n:15][n:16]1)[OH:28]

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 6422Trifluoroacetic acid

HCID 76558763tert-butyl N-[1-hydroxy-1-[5-[4-(trifluoromethoxy)phenyl]-1,3,4-oxadiazol-2-yl]butan-2-yl]carbamate

생성물 1

HCID 688238492-Amino-1-[5-[4-(trifluoromethoxy)phenyl]-1,3,4-oxadiazol-2-yl]butan-1-ol

출처 및 근거

ORD 기록: ord-20f58a0be61e4a5093d14599d52b9328
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

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