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Hydrochloric Acid → HCID 68453320, 화합물

HRID 2345787
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HRID 2345787 반응식
[Br:22][N:23]1[C:24](=[O:25])[CH2:26][CH2:27][C:28]1=[O:29].[C:31]([CH3:32])([CH3:33])([CH3:34])[O:35][C:36]([CH2:37][CH2:38][NH2:39])=[O:40].[C:43]([Cl:44])([Cl:45])([Cl:46])[Cl:47].[Cl:1][c:2]1[c:3]([C:18]([F:19])([F:20])[F:21])[cH:4][c:5](-[c:8]2[cH:9][c:10]3[c:11]([s:12]2)[cH:13][cH:14][c:15]([CH3:17])[cH:16]3)[cH:6][cH:7]1.[ClH:30].[H-:41].[Na+:42].[O:48]=[CH:49][N:50]([CH3:51])[CH3:52]>>[Cl:1][c:2]1[c:3]([C:18]([F:19])([F:20])[F:21])[cH:4][c:5](-[c:8]2[cH:9][c:10]3[c:11]([s:12]2)[cH:13][cH:14][c:15]([CH2:17][NH:39][CH2:38][CH2:37][C:36]([O:35][C:31]([CH3:32])([CH3:33])[CH3:34])=[O:40])[cH:16]3)[cH:6][cH:7]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 313Hydrochloric AcidHCID 923Sodium IonHCID 5943Carbon TetrachlorideHCID 6228DimethylformamideHCID 67184N-bromobutanimideHCID 166653HydrideHCID 4192171tert-Butyl 3-aminopropanoate
HCID 68451732
2-[4-Chloro-3-(trifluoromethyl)phenyl]-5-methyl-1-benzothiophene

생성물 1

HCID 68453320HCID 68453320, 화합물

출처 및 근거

ORD 기록
ord-85620459e2124a209f15528d41648072
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI
10.1039/C8SC04228D

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