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Toluene → Benzene, 2-(azidomethyl)-4-chloro-1-(trifluoromethoxy)-

HRID 86686
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HRID 86686 반응식
[CH2:1]1[CH2:2][CH2:3][C:4]2=[N:9][CH2:8][CH2:7][CH2:6][N:5]2[CH2:10][CH2:11]1.[CH3:43][CH2:44][O:45][C:46]([CH3:47])=[O:48].[CH3:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1.[Cl:12][c:13]1[cH:14][cH:15][c:16]([O:21][C:22]([F:23])([F:24])[F:25])[c:17]([CH2:19][OH:20])[cH:18]1.[c:26]1([P:27]([c:28]2[cH:29][cH:30][cH:31][cH:32][cH:33]2)(=[O:34])[N:40]=[N+:41]=[N-:42])[cH:35][cH:36][cH:37][cH:38][cH:39]1>>[Cl:12][c:13]1[cH:14][cH:15][c:16]([O:21][C:22]([F:23])([F:24])[F:25])[c:17]([CH2:19][N:40]=[N+:41]=[N-:42])[cH:18]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 1140TolueneHCID 8857Ethyl AcetateHCID 811841,8-Diazabicyclo(5.4.0)undec-7-eneHCID 199401P,P-Diphenylphosphinic azideHCID 573686245-Chloro-2-(trifluoromethoxy)benzyl alcohol

생성물 1

HCID 57885582Benzene, 2-(azidomethyl)-4-chloro-1-(trifluoromethoxy)-

출처 및 근거

ORD 기록
ord-cac3339f003841ada6d7937ea1454423
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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