Ethanol → HCID 178522368, compound
Reaction equation
[CH2:57]([OH:58])[CH3:59].[Cl:1][c:2]1[cH:3][cH:4][c:5]([N:8]2[CH2:9][CH:10]([NH:23][C:24]([O:25][CH2:26][c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)=[O:33])[CH:11]([c:14]3[c:15]([F:22])[cH:16][c:17]([F:21])[c:18]([F:20])[cH:19]3)[CH2:12][CH2:13]2)[n:6][n:7]1.[Na+:44].[Na+:45].[O-:46][C:47](=[O:48])[O-:49].[OH:34][B:35]([OH:36])[c:37]1[cH:38][cH:39][c:40]([F:41])[cH:42][cH:43]1.[c:50]1([CH3:51])[cH:52][cH:53][cH:54][cH:55][cH:56]1>>[c:2]1(-[c:37]2[cH:38][cH:39][c:40]([F:41])[cH:42][cH:43]2)[cH:3][cH:4][c:5]([N:8]2[CH2:9][CH:10]([NH:23][C:24]([O:25][CH2:26][c:27]3[cH:28][cH:29][cH:30][cH:31][cH:32]3)=[O:33])[CH:11]([c:14]3[c:15]([F:22])[cH:16][c:17]([F:21])[c:18]([F:20])[cH:19]3)[CH2:12][CH2:13]2)[n:6][n:7]1Participants
7
Sources & evidence
- ORD record
- ord-71324dc8f6914346b144f0ce89ba25c1
- Source dataset
- Test data from https://doi.org/10.1039/C8SC04228D
Reaction notes
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