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Ethanol → tert-Butyl 5-chloro-2-{[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]methylidene}pentanoate

HRID 2156537
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반응식

HRID 2156537 반응식
[C:17]([CH3:18])([CH3:19])([CH3:20])[O:21][C:22]([CH:23]([CH2:24][CH2:25][CH2:26][Cl:27])[P:28]([O:29][CH2:30][CH3:31])([O:32][CH2:33][CH3:34])=[O:35])=[O:36].[CH2:41]1[O:42][CH2:43][CH2:44][CH2:45]1.[CH3:1][O:2][c:3]1[cH:4][c:5]([CH:6]=[O:7])[cH:8][cH:9][c:10]1-[n:11]1[cH:12][n:13][c:14]([CH3:16])[cH:15]1.[CH3:46][CH2:47][OH:48].[CH3:49][CH2:50][O:51][C:52](=[O:53])[CH3:54].[Li+:39].[OH-:38].[OH2:37].[OH2:40]>>[CH3:1][O:2][c:3]1[cH:4][c:5]([CH:6]=[C:23]([C:22]([O:21][C:17]([CH3:18])([CH3:19])[CH3:20])=[O:36])[CH2:24][CH2:25][CH2:26][Cl:27])[cH:8][cH:9][c:10]1-[n:11]1[cH:12][n:13][c:14]([CH3:16])[cH:15]1
참가 물질출처 및 근거반응 노트

참가 물질

9

반응물 8

HCID 702EthanolHCID 961HydroxideHCID 962Water2회HCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 28486Lithium ionHCID 272824453-methoxy-4-(4-methyl-1H-imidazol-1-yl)benzaldehyde
HCID 86602480
Tert-butyl 5-chloro-2-(diethoxyphosphoryl)valerate

생성물 1

HCID 66961131tert-Butyl 5-chloro-2-{[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]methylidene}pentanoate

출처 및 근거

ORD 기록
ord-34487b00f364488ab33d8f4c4707c777
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI
10.1039/C8SC04228D

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