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Phenol → 4-(3-Chloro-4-fluorophenyl)-3-[4-(phenoxymethyl)-1,2,5-oxadiazol-3-yl]-1,2,4-oxadiazol-5(4H)-one

HRID 288109
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인쇄 미리보기

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HRID 288109 반응식
[CH2:60]1[O:61][CH2:62][CH2:63][CH2:64]1.[Cl:1][c:2]1[cH:3][c:4](-[n:9]2[c:10](-[c:15]3[n:16][o:17][n:18][c:19]3[CH2:20][OH:21])[n:11][o:12][c:13]2=[O:14])[cH:5][cH:6][c:7]1[F:8].[O:48]=[C:49]([O:50][CH2:51][CH3:52])[N:53]=[N:54][C:55]([O:56][CH2:57][CH3:58])=[O:59].[OH:22][c:23]1[cH:24][cH:25][cH:26][cH:27][cH:28]1.[c:29]1([P:30]([c:31]2[cH:32][cH:33][cH:34][cH:35][cH:36]2)[c:37]2[cH:38][cH:39][cH:40][cH:41][cH:42]2)[cH:43][cH:44][cH:45][cH:46][cH:47]1>>[Cl:1][c:2]1[cH:3][c:4](-[n:9]2[c:10](-[c:15]3[n:16][o:17][n:18][c:19]3[CH2:20][O:21][c:23]3[cH:24][cH:25][cH:26][cH:27][cH:28]3)[n:11][o:12][c:13]2=[O:14])[cH:5][cH:6][c:7]1[F:8]
참가 물질출처 및 근거반응 노트

참가 물질

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반응물 5

HCID 996PhenolHCID 8028TetrahydrofuranHCID 11776TriphenylphosphineHCID 220568ethyl N-ethoxycarbonyliminocarbamateHCID 589418304-(3-Chloro-4-fluorophenyl)-3-[4-(hydroxymethyl)-1,2,5-oxadiazol-3-yl]-1,2,4-oxadiazol-5(4H)-one

생성물 1

HCID 58941927
4-(3-Chloro-4-fluorophenyl)-3-[4-(phenoxymethyl)-1,2,5-oxadiazol-3-yl]-1,2,4-oxadiazol-5(4H)-one

출처 및 근거

ORD 기록
ord-d48bd0b59e044855984b7333c9896791
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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