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Ethanol → beta-Nitrocinnamyl Perfluorooctanoate

HRID 294625
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인쇄 미리보기

반응식

HRID 294625 반응식
[CH3:14][CH2:15][N:16]([CH2:17][CH3:18])[CH2:19][CH3:20].[CH3:46][c:47]1[cH:48][cH:49][cH:50][cH:51][cH:52]1.[CH3:53][CH2:54][OH:55].[F:21][C:22]([C:23](=[O:24])[Cl:25])([C:26]([C:27]([C:28]([C:29]([C:30]([C:31]([F:32])([F:33])[F:34])([F:35])[F:36])([F:37])[F:38])([F:39])[F:40])([F:41])[F:42])([F:43])[F:44])[F:45].[N+:1](=[O:2])([O-:3])[C:4](=[CH:5][CH2:6][OH:7])[c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1>>[N+:1](=[O:2])([O-:3])[C:4](=[CH:5][CH2:6][O:7][C:23]([C:22]([F:21])([C:26]([C:27]([C:28]([C:29]([C:30]([C:31]([F:32])([F:33])[F:34])([F:35])[F:36])([F:37])[F:38])([F:39])[F:40])([F:41])[F:42])([F:43])[F:44])[F:45])=[O:24])[c:8]1[cH:9][cH:10][cH:11][cH:12][cH:13]1
참가 물질출처 및 근거반응 노트

참가 물질

6

반응물 5

HCID 702EthanolHCID 1140TolueneHCID 8471TriethylamineHCID 78978Perfluorooctanoyl chlorideHCID 54473650beta-Nitrocinnamyl alcohol

생성물 1

HCID 53639101beta-Nitrocinnamyl Perfluorooctanoate

출처 및 근거

ORD 기록
ord-795e5079957243b2aefd09f2d77c9fd4
출처 데이터셋
Training data from https://doi.org/10.1039/C8SC04228D (8/10)
DOI
10.1039/C8SC04228D

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