1-Butanol → HCID 14407141, compound

HRID 1214380Notes

Reaction equation

HRID 1214380 reaction equation
[C:35](=[O:36])([O-:37])[O-:38].[CH2:45]([OH:46])[CH2:47][CH2:48][CH3:49].[CH3:43][OH:44].[Cl:22][c:23]1[c:24]([O:30][CH2:31][CH2:32][CH2:33][Cl:34])[c:25]([Cl:29])[cH:26][cH:27][cH:28]1.[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH:9]2[CH2:10][CH2:11][NH:12][CH2:13][CH2:14]2)[c:15]2[cH:16][cH:17][c:18]([F:21])[cH:19][cH:20]2)[cH:6][cH:7]1.[I-:42].[K+:39].[K+:40].[K+:41]>>[F:1][c:2]1[cH:3][cH:4][c:5]([CH:8]([CH:9]2[CH2:10][CH2:11][N:12]([CH2:33][CH2:32][CH2:31][O:30][c:24]3[c:23]([Cl:22])[cH:28][cH:27][cH:26][c:25]3[Cl:29])[CH2:13][CH2:14]2)[c:15]2[cH:16][cH:17][c:18]([F:21])[cH:19][cH:20]2)[cH:6][cH:7]1

Participants

8

Reactant 7

HCID 2631-ButanolHCID 813Potassium Cation3×HCID 887MethanolHCID 19660Carbonate IonHCID 30165Iodide IonHCID 132505444-[Bis(4-fluorophenyl)methyl]piperidineHCID 23036379HCID 23036379, compound

Product 1

HCID 14407141HCID 14407141, compound

Sources & evidence

ORD record
ord-fc43370894254bcbaf0e79b250322f25
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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