Ethanol → tert-butyl N-{5-[amino(hydroxyimino)methyl]-2-fluorobenzyl}-N-methyl-beta-alaninate

반응식

[C:3](#[N:4])[c:5]1[cH:6][cH:7][c:8]([F:23])[c:9]([CH2:10][N:11]([CH2:12][CH2:13][C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[CH3:21])[cH:22]1.[CH3:24][CH2:25][OH:26].[NH2:1][OH:2]>>[N:1]([OH:2])=[C:3]([NH2:4])[c:5]1[cH:6][cH:7][c:8]([F:23])[c:9]([CH2:10][N:11]([CH2:12][CH2:13][C:14](=[O:15])[O:16][C:17]([CH3:18])([CH3:19])[CH3:20])[CH3:21])[cH:22]1

참가 물질

반응물 3

HCID 702Ethanol

HCID 787Hydroxylamine

HCID 66677998tert-butyl N-(5-cyano-2-fluorobenzyl)-N-methyl-beta-alaninate

생성물 1

HCID 72307493tert-butyl N-{5-[amino(hydroxyimino)methyl]-2-fluorobenzyl}-N-methyl-beta-alaninate

출처 및 근거

ORD 기록: ord-d87206d6a5084ab690cb8d6b95971b5f
출처 데이터셋: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

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