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Methanol → 6-(1-imidazol-1-yl-3-methylbutan-2-yl)oxy-5-nitro-3,4-dihydro-2H-naphthalen-1-one

HRID 1537570
노트
인쇄 미리보기

반응식

HRID 1537570 반응식
[CH2:32]1[O:33][CH2:34][CH2:35][CH2:36]1.[CH3:27][OH:28].[Cl:29][CH2:30][Cl:31].[OH:1][c:2]1[c:3]([N+:13](=[O:14])[O-:15])[c:4]2[c:9]([cH:10][cH:11]1)[C:8](=[O:12])[CH2:7][CH2:6][CH2:5]2.[n:16]1([CH2:21][CH:22]([CH:23]([CH3:24])[CH3:25])[OH:26])[cH:17][n:18][cH:19][cH:20]1>>[O:1]([c:2]1[c:3]([N+:13](=[O:14])[O-:15])[c:4]2[c:9]([cH:10][cH:11]1)[C:8](=[O:12])[CH2:7][CH2:6][CH2:5]2)[CH:22]([CH2:21][n:16]1[cH:17][n:18][cH:19][cH:20]1)[CH:23]([CH3:24])[CH3:25]
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 887MethanolHCID 6344DichloromethaneHCID 8028TetrahydrofuranHCID 123928306-Hydroxy-5-nitro-3,4-dihydronaphthalen-1(2H)-oneHCID 223247001-(1H-imidazol-1-yl)-3-methyl-2-butanol

생성물 1

HCID 223249436-(1-imidazol-1-yl-3-methylbutan-2-yl)oxy-5-nitro-3,4-dihydro-2H-naphthalen-1-one

출처 및 근거

ORD 기록
ord-764a693e88ba4fe2b6c2f262f7d500f8
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI
10.1039/C8SC04228D

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