3-Fluorophenol → HCID 178430339, compound

HRID 1573193Notes

Reaction equation

HRID 1573193 reaction equation
[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]([C:8](=[O:9])[N:10]([c:11]2[cH:12][cH:13][c:14]([CH2:17][N:18]3[CH2:19][CH:20]([CH3:31])[N:21]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:22][CH2:23]3)[cH:15][cH:16]2)[CH3:32])[n:7]1.[F:33][c:34]1[cH:35][c:36]([OH:40])[cH:37][cH:38][cH:39]1.[F:41][c:42]1[cH:43][cH:44][c:45]([O:46][c:47]2[n:48][c:49]([C:50]([N:51]([CH3:52])[c:53]3[cH:54][cH:55][c:56]([CH2:57][N:58]4[CH2:59][CH2:60][N:61]([C:62]([O:63][C:64]([CH3:65])([CH3:66])[CH3:67])=[O:68])[CH:69]([CH3:70])[CH2:71]4)[cH:72][cH:73]3)=[O:74])[cH:75][cH:76][cH:77]2)[cH:78][cH:79]1>>[c:2]1([O:40][c:36]2[cH:35][c:34]([F:33])[cH:39][cH:38][cH:37]2)[cH:3][cH:4][cH:5][c:6]([C:8](=[O:9])[N:10]([c:11]2[cH:12][cH:13][c:14]([CH2:17][N:18]3[CH2:19][CH:20]([CH3:31])[N:21]([C:24](=[O:25])[O:26][C:27]([CH3:28])([CH3:29])[CH3:30])[CH2:22][CH2:23]3)[cH:15][cH:16]2)[CH3:32])[n:7]1

Participants

4

Sources & evidence

ORD record
ord-a2fe6ef232574a678d761faa93fe24f4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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