tert-Butyl 2-bromopropanoate → tert-butyl 2-[4-cyano-3-(trifluoromethyl)-N-(3,3,3-trifluoropropyl)anilino]propanoate

HRID 113694

반응식

HRID 113694 반응식
[Br:20][CH:21]([C:22](=[O:23])[O:24][C:25]([CH3:26])([CH3:27])[CH3:28])[CH3:29].[F:1][C:2]([c:3]1[c:4]([C:5]#[N:6])[cH:7][cH:8][c:9]([NH:11][CH2:12][CH2:13][C:14]([F:15])([F:16])[F:17])[cH:10]1)([F:18])[F:19]>>[F:1][C:2]([c:3]1[c:4]([C:5]#[N:6])[cH:7][cH:8][c:9]([N:11]([CH2:12][CH2:13][C:14]([F:15])([F:16])[F:17])[CH:21]([C:22](=[O:23])[O:24][C:25]([CH3:26])([CH3:27])[CH3:28])[CH3:29])[cH:10]1)([F:18])[F:19]

참가 물질

3

반응물 2

HCID 545327tert-Butyl 2-bromopropanoateHCID 576337572-(Trifluoromethyl)-4-[(3,3,3-trifluoropropyl)amino]benzonitrile

생성물 1

HCID 57633770tert-butyl 2-[4-cyano-3-(trifluoromethyl)-N-(3,3,3-trifluoropropyl)anilino]propanoate

출처 및 근거

ORD 기록
ord-b36dbbb4c62d4da1b24c5cd563652213
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

연결된 노트

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