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Sodium Ion → 5-Phenylthio-2-(2-hydroxy-3,5-di-tert-butylphenyl)-2H-benzotriazole

HRID 104725
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HRID 104725 반응식
[CH3:45][N:46]([CH3:47])[CH:48]=[O:49].[Cl:1][c:2]1[cH:3][c:4]2[c:5]([n:6][n:7](-[c:9]3[c:10]([OH:23])[c:11]([C:19]([CH3:20])([CH3:21])[CH3:22])[cH:12][c:13]([C:15]([CH3:16])([CH3:17])[CH3:18])[cH:14]3)[n:8]2)[cH:24][cH:25]1.[Na+:34].[OH-:33].[OH2:44].[SH:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[nH:35]1[c:36]2[cH:37][cH:38][cH:39][cH:40][c:41]2[n:42][n:43]1>>[c:2]1([S:26][c:27]2[cH:28][cH:29][cH:30][cH:31][cH:32]2)[cH:3][c:4]2[c:5]([n:6][n:7](-[c:9]3[c:10]([OH:23])[c:11]([C:19]([CH3:20])([CH3:21])[CH3:22])[cH:12][c:13]([C:15]([CH3:16])([CH3:17])[CH3:18])[cH:14]3)[n:8]2)[cH:24][cH:25]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 923Sodium IonHCID 961HydroxideHCID 962WaterHCID 6228DimethylformamideHCID 7969ThiophenolHCID 774702,4-Di-tert-butyl-6-(5-chloro-2H-benzotriazol-2-yl)phenolHCID 178418385HCID 178418385, 화합물

생성물 1

HCID 19349150
5-Phenylthio-2-(2-hydroxy-3,5-di-tert-butylphenyl)-2H-benzotriazole

출처 및 근거

ORD 기록
ord-f3654dca65c342c69f0d96fc7594fe5e
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI
10.1039/C8SC04228D

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