Benzene → HCID 12947560, compound

HRID 1129531Notes

Reaction equation

HRID 1129531 reaction equation
[CH3:48][OH:49].[CH3:8][CH2:9][CH2:10][CH2:11][CH2:12][CH3:13].[O:20]=[C:21]1[N:22]([CH3:47])[CH2:23][CH2:24][C:25]2([c:39]3[cH:40][c:41]([O:45][CH3:46])[cH:42][cH:43][cH:44]3)[CH2:26][C:27](=[O:38])[CH:28]([C:31]([O:32][C:33]([CH3:34])([CH3:35])[CH3:36])=[O:37])[CH2:29][CH:30]12.[OH:1][C:2]([C:3]([F:4])([F:5])[F:6])=[O:7].[cH:14]1[cH:15][cH:16][cH:17][cH:18][cH:19]1.[cH:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1>>[O:20]=[C:21]1[N:22]([CH3:47])[CH2:23][CH2:24][C:25]2([c:39]3[cH:40][c:41]([O:45][CH3:46])[cH:42][cH:43][cH:44]3)[CH2:26][C:27](=[O:38])[CH2:28][CH2:29][CH:30]12

Participants

6

Reactant 5

HCID 241Benzene2×HCID 887MethanolHCID 6422Trifluoroacetic acidHCID 8058HexaneHCID 12947557HCID 12947557, compound

Product 1

HCID 12947560HCID 12947560, compound

Sources & evidence

ORD record
ord-9cc79bbd4bb64001a87a3ca11083bcdd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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