Tetrahydrofuran → 2-Nitro-5-thiomorpholin-4-yl-4-trifluoromethyl-benzoic acid methyl ester

반응식

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

참가 물질

반응물 3

HCID 8028Tetrahydrofuran

HCID 67164Thiomorpholine

HCID 589644905-Fluoro-2-nitro-4-trifluoromethyl-benzoic acid methyl ester

생성물 1

HCID 589645312-Nitro-5-thiomorpholin-4-yl-4-trifluoromethyl-benzoic acid methyl ester

출처 및 근거

ORD 기록: ord-b9f4b225ca9048d1b561a57ba073aa10
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI: 10.1039/C8SC04228D

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