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Hydrochloric Acid → 4-Amino-N-{[1-(4-chlorophenyl)cyclopropyl]methyl}-3-fluorobenzamide

HRID 1141509
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HRID 1141509 반응식
[CH3:19][N+:20]([CH3:21])=[C:22]([N:23]([CH3:24])[CH3:25])[O:26][n:27]1[c:28]2[n:29][cH:30][cH:31][cH:32][c:33]2[n:34][n:35]1.[CH3:36][N:37]([CH3:38])[CH:39]=[O:40].[CH:41]([N:42]([CH2:43][CH3:44])[CH:45]([CH3:46])[CH3:47])([CH3:48])[CH3:49].[Cl:50][c:51]1[cH:52][cH:53][c:54]([C:57]2([CH2:60][NH2:61])[CH2:58][CH2:59]2)[cH:55][cH:56]1.[ClH:62].[NH2:1][c:2]1[c:3]([F:11])[cH:4][c:5]([C:6](=[O:7])[OH:8])[cH:9][cH:10]1.[P-:12]([F:13])([F:14])([F:15])([F:16])([F:17])[F:18]>>[NH2:1][c:2]1[c:3]([F:11])[cH:4][c:5]([C:6](=[O:8])[NH:61][CH2:60][C:57]2([c:54]3[cH:53][cH:52][c:51]([Cl:50])[cH:56][cH:55]3)[CH2:58][CH2:59]2)[cH:9][cH:10]1
참가 물질출처 및 근거반응 노트

참가 물질

8

반응물 7

HCID 313Hydrochloric AcidHCID 6228DimethylformamideHCID 9886HexafluorophosphateHCID 99714-Amino-3-fluorobenzoic acidHCID 81531DiisopropylethylamineHCID 4120166[1-(4-Chlorophenyl)cyclopropyl]methanamineHCID 4641409(Dimethylamino)-N,N-dimethyl(3H-(1,2,3)triazolo(4,5-b)pyridin-3-yloxy)methaniminium

생성물 1

HCID 577320174-Amino-N-{[1-(4-chlorophenyl)cyclopropyl]methyl}-3-fluorobenzamide

출처 및 근거

ORD 기록
ord-1404e30154664840a4af16b694df0269
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI
10.1039/C8SC04228D

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