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Ethanol → 3-Chloro-6-(methylaminomethyl)-5,6-dihydrobenzo[b][1]benzoxepine-5-carboxylic acid

HRID 180727
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인쇄 미리보기

반응식

HRID 180727 반응식
[CH3:24][CH2:25][O:26][C:27](=[O:28])[CH3:29].[CH3:30][CH2:31][OH:32].[Cl:1][c:2]1[cH:3][c:4]2[c:5]([cH:20][cH:21]1)[O:6][c:7]1[c:8]([cH:16][cH:17][cH:18][cH:19]1)[CH:9]1[CH:10]2[C:11](=[O:15])[N:12]([CH3:14])[CH2:13]1.[K+:23].[OH-:22]>>[Cl:1][c:2]1[cH:3][c:4]2[c:5]([cH:20][cH:21]1)[O:6][c:7]1[c:8]([cH:16][cH:17][cH:18][cH:19]1)[CH:9]([CH2:13][NH:12][CH3:14])[CH:10]2[C:11]([OH:15])=[O:26]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 702EthanolHCID 813Potassium CationHCID 961HydroxideHCID 8857Ethyl AcetateHCID 5782692911-Chloro-2-methyl-2,3,3a,12b-tetrahydro-1H-dibenzo[2,3:6,7]oxepino[4,5-c]pyrrol-1-one

생성물 1

HCID 231486593-Chloro-6-(methylaminomethyl)-5,6-dihydrobenzo[b][1]benzoxepine-5-carboxylic acid

출처 및 근거

ORD 기록
ord-48776d14911d47079f28305f8bfd1229
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI
10.1039/C8SC04228D

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