Diethyl Ether → Flucycloxuron

HRID 1216288

반응식

HRID 1216288 반응식
[CH3:35][CH2:36][O:37][CH2:38][CH3:39].[CH:14]1([C:17]([c:18]2[cH:19][cH:20][c:21]([Cl:24])[cH:22][cH:23]2)=[N:25][O:26][CH2:27][c:28]2[cH:29][cH:30][c:31]([NH2:32])[cH:33][cH:34]2)[CH2:15][CH2:16]1.[F:1][c:2]1[c:3]([C:4](=[O:5])[N:6]=[C:7]=[O:8])[c:9]([F:13])[cH:10][cH:11][cH:12]1>>[F:1][c:2]1[c:3]([C:4](=[O:5])[NH:6][C:7](=[O:8])[NH:32][c:31]2[cH:30][cH:29][c:28]([CH2:27][O:26][N:25]=[C:17]([CH:14]3[CH2:15][CH2:16]3)[c:18]3[cH:19][cH:20][c:21]([Cl:24])[cH:22][cH:23]3)[cH:34][cH:33]2)[c:9]([F:13])[cH:10][cH:11][cH:12]1

참가 물질

4

반응물 3

HCID 3283Diethyl EtherHCID 27333692,6-Difluorobenzoyl isocyanateHCID 54230357(4-Chlorophenyl)cyclopropylmethanone O-[(4-aminophenyl)methyl]oxime

생성물 1

HCID 86309Flucycloxuron

출처 및 근거

ORD 기록
ord-61af0f88b38145cab6bdd94ce9100a95
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

연결된 노트

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