1-Butanol → HCID 67267160, compound

HRID 285369Notes

Reaction equation

HRID 285369 reaction equation
[CH2:34]([OH:35])[CH2:36][CH2:37][CH3:38].[CH3:40][CH2:41][N:42]([CH2:43][CH3:44])[CH2:45][CH3:46].[Cl:23][c:24]1[n:25][c:26]2[cH:27][cH:28][cH:29][cH:30][c:31]2[n:32][cH:33]1.[F:1][c:2]1[cH:3][c:4](-[c:8]2[n:9][cH:10][c:11]([C:12](=[O:13])[NH:14][CH:15]3[CH2:16][NH:17][CH2:18][CH:19]3[OH:20])[cH:21][cH:22]2)[cH:5][cH:6][cH:7]1.[OH2:39]>>[F:1][c:2]1[cH:3][c:4](-[c:8]2[n:9][cH:10][c:11]([C:12](=[O:13])[NH:14][CH:15]3[CH2:16][N:17]([c:24]4[n:25][c:26]5[cH:27][cH:28][cH:29][cH:30][c:31]5[n:32][cH:33]4)[CH2:18][CH:19]3[OH:20])[cH:21][cH:22]2)[cH:5][cH:6][cH:7]1

Participants

6

Reactant 5

HCID 2631-ButanolHCID 962WaterHCID 8471TriethylamineHCID 2389382-ChloroquinoxalineHCID 67070406HCID 67070406, compound

Product 1

HCID 67267160HCID 67267160, compound

Sources & evidence

ORD record
ord-0c0fc5e16e4c423e812c7d6d7f77ed03
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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