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Hydrochloric Acid → ethyl 2-[3-(2-fluorophenyl)-N-methylprop-2-ynoylamino]acetate

HRID 1226298
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HRID 1226298 반응식
[CH2:2]([CH3:3])[O:4][C:5]([CH2:6][NH:7][CH3:8])=[O:9].[CH3:22][CH2:23][N:24]=[C:25]=[N:26][CH2:27][CH2:28][CH2:29][N:30]([CH3:31])[CH3:32].[CH3:34][N:35]([c:36]1[cH:37][cH:38][n:39][cH:40][cH:41]1)[CH3:42].[Cl:43][CH2:44][Cl:45].[ClH:1].[ClH:33].[F:10][c:11]1[c:12]([C:17]#[C:18][C:19](=[O:20])[OH:21])[cH:13][cH:14][cH:15][cH:16]1>>[CH2:2]([CH3:3])[O:4][C:5]([CH2:6][N:7]([CH3:8])[C:19]([C:18]#[C:17][c:12]1[c:11]([F:10])[cH:16][cH:15][cH:14][cH:13]1)=[O:21])=[O:9]
참가 물질출처 및 근거반응 노트

참가 물질

7

반응물 6

HCID 313Hydrochloric Acid2회HCID 6344DichloromethaneHCID 142844-(Dimethylamino)pyridineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 95849Glycine, N-methyl-, ethyl esterHCID 226776553-(2-Fluorophenyl)prop-2-ynoic acid

생성물 1

HCID 22677637ethyl 2-[3-(2-fluorophenyl)-N-methylprop-2-ynoylamino]acetate

출처 및 근거

ORD 기록
ord-ff5053a71ef046689fe288a8d2e70ee8
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (5/10)
DOI
10.1039/C8SC04228D

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