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Water → 4-(3-Fluoro-2-methoxyphenyl)-1-[(2-methylquinazolin-5-yl)imino]-2-(trifluoromethyl)heptan-2-ol

HRID 829665
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인쇄 미리보기

반응식

HRID 829665 반응식
[CH3:36][c:37]1[cH:38][cH:39][cH:40][cH:41][cH:42]1.[CH3:43][CH2:44][O-:45].[CH3:46][CH2:47][O-:48].[CH3:49][CH2:50][O-:51].[CH3:52][CH2:53][O-:54].[F:1][c:2]1[c:3]([O:21][CH3:22])[c:4]([CH:8]([CH2:9][C:10]([CH:11]=[O:12])([C:13]([F:14])([F:15])[F:16])[OH:17])[CH2:18][CH2:19][CH3:20])[cH:5][cH:6][cH:7]1.[NH2:23][c:24]1[c:25]2[cH:26][n:27][c:28]([CH3:34])[n:29][c:30]2[cH:31][cH:32][cH:33]1.[OH2:35].[Ti+4:55]>>[F:1][c:2]1[c:3]([O:21][CH3:22])[c:4]([CH:8]([CH2:9][C:10]([CH:11]=[N:23][c:24]2[c:25]3[cH:26][n:27][c:28]([CH3:34])[n:29][c:30]3[cH:31][cH:32][cH:33]2)([C:13]([F:14])([F:15])[F:16])[OH:17])[CH2:18][CH2:19][CH3:20])[cH:5][cH:6][cH:7]1
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 962WaterHCID 1140TolueneHCID 114942Titanium cation (4+)HCID 1194401-Hydroxyethyl radical4회HCID 179850582-Methylquinazolin-5-amineHCID 866153274-(3-Fluoro-2-methoxyphenyl)-2-hydroxy-2-(trifluoromethyl)heptanal

생성물 1

HCID 66969612
4-(3-Fluoro-2-methoxyphenyl)-1-[(2-methylquinazolin-5-yl)imino]-2-(trifluoromethyl)heptan-2-ol

출처 및 근거

ORD 기록
ord-056cfde50ee845288c301ad2391ee677
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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