Toluene → 4-(4-Fluorophenylmethoxy)-2-fluorophenyl isocyanate

반응식

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

참가 물질

반응물 3

HCID 1140Toluene

HCID 10426Diphosgene

HCID 221378852-Fluoro-4-(4-fluoro-benzyloxy)-phenylamine

생성물 1

HCID 189810564-(4-Fluorophenylmethoxy)-2-fluorophenyl isocyanate

출처 및 근거

ORD 기록: ord-b291c42430e6462b8fdcf746cfddb681
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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