Acetonitrile → Benzyl-(2,6-dichloro-3-nitro-pyridin-4-yl)-carbamic acid ethyl ester

반응식

[Br:1][CH2:2][c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1.[CH2:9]([CH3:10])[O:11][C:12]([NH:13][c:14]1[c:15]([N+:22](=[O:23])[O-:24])[c:16]([Cl:21])[n:17][c:18]([Cl:20])[cH:19]1)=[O:25].[CH3:26][C:27]#[N:28]>>[CH2:2]([c:3]1[cH:4][cH:5][cH:6][cH:7][cH:8]1)[N:13]([C:12]([O:11][CH2:9][CH3:10])=[O:25])[c:14]1[c:15]([N+:22](=[O:23])[O-:24])[c:16]([Cl:21])[n:17][c:18]([Cl:20])[cH:19]1

참가 물질

반응물 3

HCID 6342Acetonitrile

HCID 7498Benzyl Bromide

HCID 57856586Ethyl (2,6-dichloro-3-nitropyridin-4-yl)carbamate

생성물 1

HCID 57856587Benzyl-(2,6-dichloro-3-nitro-pyridin-4-yl)-carbamic acid ethyl ester

출처 및 근거

ORD 기록: ord-c7c4b0115bfe404bbef10f414a9492bc
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (1/10)
DOI: 10.1039/C8SC04228D

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