Acetaldehyde → 2-Ethylamino-alpha,alpha,alpha-trifluoro-p-toluic acid ethyl ester

HRID 701114

반응식

[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][c:8]([NH2:16])[c:9]([C:12]([F:13])([F:14])[F:15])[cH:10][cH:11]1.[CH3:20][CH2:21][OH:22].[CH:17]([CH3:18])=[O:19]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[cH:7][c:8]([NH:16][CH2:17][CH3:18])[c:9]([C:12]([F:13])([F:14])[F:15])[cH:10][cH:11]1

참가 물질

반응물 3

HCID 177Acetaldehyde

HCID 702Ethanol

HCID 19783159Ethyl 3-amino-4-(trifluoromethyl)benzoate

생성물 1

HCID 867381682-Ethylamino-alpha,alpha,alpha-trifluoro-p-toluic acid ethyl ester

출처 및 근거

ORD 기록: ord-506d9844fe3443bdb6bae1360e858bcf
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

연결된 노트

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