Acetate → HCID 20230276, 화합물

HRID 160546노트

반응식

HRID 160546 반응식
[CH3:24][C:25]([O-:26])=[O:27].[Cl:1][CH2:2][c:3]1[n:4][o:5][c:6]([CH:8]([c:9]2[cH:10][c:11]([F:21])[c:12](-[c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)[cH:13][cH:14]2)[CH3:22])[n:7]1.[K+:23].[O:28]=[CH:29][N:30]([CH3:31])[CH3:32].[OH2:33]>>[CH2:2]([c:3]1[n:4][o:5][c:6]([CH:8]([c:9]2[cH:10][c:11]([F:21])[c:12](-[c:15]3[cH:16][cH:17][cH:18][cH:19][cH:20]3)[cH:13][cH:14]2)[CH3:22])[n:7]1)[O:27][C:25]([CH3:24])=[O:26]

참가 물질

6

반응물 5

HCID 175AcetateHCID 813Potassium CationHCID 962WaterHCID 6228DimethylformamideHCID 136909413-Chloromethyl-5-(3-fluoro-4-phenyl-alpha-methylbenzyl)-1,2,4-oxadiazole

생성물 1

HCID 20230276HCID 20230276, 화합물

출처 및 근거

ORD 기록
ord-46db3ebaa66e468eb8d827c1872009da
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

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