Ethanol → 3-Ethyl 5-methyl 6-(difluoromethyl)-4-(2-methylaziridinyl)-2-(trifluoromethyl)-3,5-pyridinedicarboxylate

반응식

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

참가 물질

반응물 3

HCID 702Ethanol

HCID 8471Triethylamine

HCID 140138283-Ethyl 5-methyl 6-(chlorodifluoromethyl)-4-(2-methylaziridinyl)-2-(trifluoromethyl)-3,5-pyridinedicarboxylate

생성물 1

HCID 140138303-Ethyl 5-methyl 6-(difluoromethyl)-4-(2-methylaziridinyl)-2-(trifluoromethyl)-3,5-pyridinedicarboxylate

출처 및 근거

ORD 기록: ord-5436ee9273494f1c9641a71a146c093a
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (4/10)
DOI: 10.1039/C8SC04228D

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