2-Bromoisovaleric acid → 2-(2-Chloro-4-methylanilino)-3-methylbutanoic acid

반응식

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

참가 물질

반응물 3

HCID 112682-Bromoisovaleric acid

HCID 120072-Chloro-p-toluidine

HCID 945441-(Bromomethyl)-3-phenoxybenzene

생성물 1

HCID 204827882-(2-Chloro-4-methylanilino)-3-methylbutanoic acid

출처 및 근거

ORD 기록: ord-a489a750ba1748a9a1d4de107a8660ea
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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