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Tetrahydrofuran → Ethyl [(4-{[1-(3-bromo-2-methylphenyl)pentyl]oxy}-2-methylphenyl)oxy]acetate

HRID 672176
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반응식

HRID 672176 반응식
[Br:1][c:2]1[c:3]([CH3:14])[c:4]([CH:8]([CH2:9][CH2:10][CH2:11][CH3:12])[OH:13])[cH:5][cH:6][cH:7]1.[CH2:48]([P:49]([CH2:50][CH2:51][CH2:52][CH3:53])[CH2:54][CH2:55][CH2:56][CH3:57])[CH2:58][CH2:59][CH3:60].[CH2:61]1[O:62][CH2:63][CH2:64][CH2:65]1.[N:30]([C:31]([N:32]1[CH2:33][CH2:34][CH2:35][CH2:36][CH2:37]1)=[O:38])=[N:39][C:40]([N:41]1[CH2:42][CH2:43][CH2:44][CH2:45][CH2:46]1)=[O:47].[OH:15][c:16]1[cH:17][c:18]([CH3:29])[c:19]([O:20][CH2:21][C:22](=[O:23])[O:24][CH2:25][CH3:26])[cH:27][cH:28]1>>[Br:1][c:2]1[c:3]([CH3:14])[c:4]([CH:8]([CH2:9][CH2:10][CH2:11][CH3:12])[O:13][c:16]2[cH:17][c:18]([CH3:29])[c:19]([O:20][CH2:21][C:22](=[O:23])[O:24][CH2:25][CH3:26])[cH:27][cH:28]2)[cH:5][cH:6][cH:7]1
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반응물 5

HCID 8028TetrahydrofuranHCID 13831TributylphosphineHCID 730421,1'-(Azodicarbonyl)dipiperidineHCID 21986458Ethyl (4-hydroxy-2-methylphenoxy)acetateHCID 586298181-(3-Bromo-2-methylphenyl)-1-pentanol

생성물 1

HCID 58629845Ethyl [(4-{[1-(3-bromo-2-methylphenyl)pentyl]oxy}-2-methylphenyl)oxy]acetate

출처 및 근거

ORD 기록
ord-92daa0e2774a4a138263521a9a640c79
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI
10.1039/C8SC04228D

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