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Water → [3-(4-Chloro-[1,3,5]triazin-2-ylamino)phenyl]acetic acid methyl ester

HRID 149762
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반응식

HRID 149762 반응식
[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][c:7]([NH2:11])[cH:8][cH:9][cH:10]1)=[O:12].[CH3:35][CH2:36][O:37][C:38]([CH3:39])=[O:40].[CH:13]([N:14]([CH2:15][CH3:16])[CH:17]([CH3:18])[CH3:19])([CH3:20])[CH3:21].[Cl:22][c:23]1[n:24][cH:25][n:26][c:27]([Cl:29])[n:28]1.[O:30]=[CH:31][N:32]([CH3:33])[CH3:34].[OH2:41]>>[CH3:1][O:2][C:3]([CH2:4][c:5]1[cH:6][c:7]([NH:11][c:27]2[n:26][cH:25][n:24][c:23]([Cl:22])[n:28]2)[cH:8][cH:9][cH:10]1)=[O:12]
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반응물 6

HCID 962WaterHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 178102,4-Dichloro-1,3,5-triazineHCID 81531DiisopropylethylamineHCID 13054266Methyl 3-aminophenylacetate

생성물 1

HCID 23536225[3-(4-Chloro-[1,3,5]triazin-2-ylamino)phenyl]acetic acid methyl ester

출처 및 근거

ORD 기록
ord-49072419abbb4e49bf38a75978b33d7a
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (9/10)
DOI
10.1039/C8SC04228D

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