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Acetic Acid → 3-(m-Trifluoromethylbenzylmercapto)-2,5-pyridine-dicarboxylic acid dimethyl ester

HRID 800648
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인쇄 미리보기

반응식

HRID 800648 반응식
[CH3:15][CH2:16][CH2:17][CH2:18][CH2:19][CH3:20].[CH3:21][O:22][C:23](=[O:24])[c:25]1[n:26][cH:27][c:28]([C:34](=[O:35])[O:36][CH3:37])[cH:29][c:30]1[N+:31]([O-:32])=[O:33].[CH3:38][N:39]([CH3:40])[CH:41]=[O:42].[CH3:44][C:45](=[O:46])[OH:47].[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][SH:7])[cH:8][cH:9][cH:10]1)([F:11])[F:12].[H-:13].[Na+:14].[OH2:43]>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][S:7][c:30]2[c:25]([C:23]([O:22][CH3:21])=[O:24])[n:26][cH:27][c:28]([C:34](=[O:35])[O:36][CH3:37])[cH:29]2)[cH:8][cH:9][cH:10]1)([F:11])[F:12]
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 176Acetic AcidHCID 923Sodium IonHCID 962WaterHCID 6228DimethylformamideHCID 8058HexaneHCID 1412363-(Trifluoromethyl)benzyl mercaptanHCID 166653HydrideHCID 539752273-Nitro-2,5-pyridinedicarboxylic acid dimethyl ester
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생성물 1

HCID 540247893-(m-Trifluoromethylbenzylmercapto)-2,5-pyridine-dicarboxylic acid dimethyl ester

출처 및 근거

ORD 기록
ord-763cb844524e484a835bad31866863b9
출처 데이터셋
Test data from https://doi.org/10.1039/C8SC04228D
DOI
10.1039/C8SC04228D

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