Dichloromethane → 2-(2-amino-ethyl)-4-(4-fluoro-phenyl)-5-formyl-1H-pyrrole-3-carboxylic acid ethyl ester

반응식

[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7]([CH2:20][CH2:21][NH:22][C:23]([O:24][C:25]([CH3:26])([CH3:27])[CH3:28])=[O:29])[nH:8][c:9]([CH:18]=[O:19])[c:10]1-[c:11]1[cH:12][cH:13][c:14]([F:17])[cH:15][cH:16]1.[Cl:37][CH2:38][Cl:39].[OH:30][C:31]([C:32]([F:33])([F:34])[F:35])=[O:36]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[c:7]([CH2:20][CH2:21][NH2:22])[nH:8][c:9]([CH:18]=[O:19])[c:10]1-[c:11]1[cH:12][cH:13][c:14]([F:17])[cH:15][cH:16]1

참가 물질

반응물 3

HCID 6344Dichloromethane

HCID 6422Trifluoroacetic acid

HCID 866376812-(2-tert-butoxycarbonylamino-ethyl)-4-(4-fluoro-phenyl)-5-formyl-1H-pyrrole-3-carboxylic acid ethyl ester

생성물 1

HCID 866376822-(2-amino-ethyl)-4-(4-fluoro-phenyl)-5-formyl-1H-pyrrole-3-carboxylic acid ethyl ester

출처 및 근거

ORD 기록: ord-f8b33ef9563d41e8b2dc20b739af4c95
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (10/10)
DOI: 10.1039/C8SC04228D

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