Acetic Acid → 2-(4-aminophenyl)-N-octylcyclopropane-1-carboxamide

반응식

[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH3:8])[NH:9][C:10](=[O:11])[CH:12]1[CH:13]([c:15]2[cH:16][cH:17][c:18]([N+:21]([O-:22])=[O:23])[cH:19][cH:20]2)[CH2:14]1.[CH3:25][C:26](=[O:27])[OH:28].[Fe:24]>>[CH2:1]([CH2:2][CH2:3][CH2:4][CH2:5][CH2:6][CH2:7][CH3:8])[NH:9][C:10](=[O:11])[CH:12]1[CH:13]([c:15]2[cH:16][cH:17][c:18]([NH2:21])[cH:19][cH:20]2)[CH2:14]1

참가 물질

반응물 3

HCID 176Acetic Acid

HCID 23925Iron

HCID 128546322-(4-nitrophenyl)-N-octylcyclopropane-1-carboxamide

생성물 1

HCID 128546342-(4-aminophenyl)-N-octylcyclopropane-1-carboxamide

출처 및 근거

ORD 기록: ord-a0e362b556a5449d85af84f1b405edac
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (2/10)
DOI: 10.1039/C8SC04228D

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