Acetic Anhydride → Ethyl 2-(2,4-dichloro-5-fluoro-3-nitrobenzoyl)-3-ethoxyacrylate

반응식

[CH3:31][C:32]([O:33][C:34](=[O:35])[CH3:36])=[O:37].[CH:21]([O:22][CH2:23][CH3:24])([O:25][CH2:26][CH3:27])[O:28][CH2:29][CH3:30].[Cl:1][c:2]1[c:3]([C:4](=[O:5])[CH2:6][C:7](=[O:8])[O:9][CH2:10][CH3:11])[cH:12][c:13]([F:20])[c:14]([Cl:19])[c:15]1[N+:16](=[O:17])[O-:18]>>[Cl:1][c:2]1[c:3]([C:4](=[O:5])[C:6]([C:7](=[O:8])[O:9][CH2:10][CH3:11])=[CH:21][O:22][CH2:23][CH3:24])[cH:12][c:13]([F:20])[c:14]([Cl:19])[c:15]1[N+:16](=[O:17])[O-:18]

참가 물질

반응물 3

HCID 7918Acetic Anhydride

HCID 31214Ethyl orthoformate

HCID 13733140Ethyl 2,4-dichloro-5-fluoro-3-nitro-beta-oxobenzenepropanoate

생성물 1

HCID 53944414Ethyl 2-(2,4-dichloro-5-fluoro-3-nitrobenzoyl)-3-ethoxyacrylate

출처 및 근거

ORD 기록: ord-05cbada870184a01b8b558bdcc21cc52
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

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