Nitromethane → 3-[5-(2-Methylsulfanyl-pyrimidin-4-yl)-thiophen-2-yl]-4-nitro-butyric acid methyl ester

반응식

[CH3:1][O:2][C:3]([CH:4]=[CH:5][c:6]1[s:7][c:8](-[c:11]2[n:12][c:13]([S:17][CH3:18])[n:14][cH:15][cH:16]2)[cH:9][cH:10]1)=[O:19].[CH3:24][CH2:25][O:26][C:27]([CH3:28])=[O:29].[N+:20](=[O:21])([O-:22])[CH3:23]>>[CH3:1][O:2][C:3]([CH2:4][CH:5]([c:6]1[s:7][c:8](-[c:11]2[n:12][c:13]([S:17][CH3:18])[n:14][cH:15][cH:16]2)[cH:9][cH:10]1)[CH2:23][N+:20](=[O:21])[O-:22])=[O:19]

참가 물질

반응물 3

HCID 6375Nitromethane

HCID 8857Ethyl Acetate

HCID 69062170Methyl 3-[5-(2-methylsulfanylpyrimidin-4-yl)thiophen-2-yl]prop-2-enoate

생성물 1

HCID 579361643-[5-(2-Methylsulfanyl-pyrimidin-4-yl)-thiophen-2-yl]-4-nitro-butyric acid methyl ester

출처 및 근거

ORD 기록: ord-d5c0860e986d4ba790e887039b594ec0
출처 데이터셋: Test data from https://doi.org/10.1039/C8SC04228D
DOI: 10.1039/C8SC04228D

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