Sodium ion → 4-[2-hydroxy-3-[[1-(3,3,3-trifluoropropyl)piperidin-4-yl]methylamino]propoxy]-9H-fluoren-9-ol

HRID 2148011Notes

Reaction equation

HRID 2148011 reaction equation
[Al+3:35].[CH2:49]1[O:50][CH2:51][CH2:52][CH2:53]1.[H-:34].[H-:37].[H-:38].[H-:39].[Li+:36].[Na+:41].[Na+:42].[Na+:43].[O-:44][S:45]([O-:46])(=[O:47])=[O:48].[OH-:40].[OH2:54].[OH:1][CH:2]([CH2:3][O:4][c:5]1[cH:6][cH:7][cH:8][c:9]2[c:17]1-[c:16]1[c:11]([cH:12][cH:13][cH:14][cH:15]1)[C:10]2=[O:18])[CH2:19][NH:20][CH2:21][CH:22]1[CH2:23][CH2:24][N:25]([CH2:28][CH2:29][C:30]([F:31])([F:32])[F:33])[CH2:26][CH2:27]1>>[OH:1][CH:2]([CH2:3][O:4][c:5]1[cH:6][cH:7][cH:8][c:9]2[c:17]1-[c:16]1[c:11]([cH:12][cH:13][cH:14][cH:15]1)[CH:10]2[OH:18])[CH2:19][NH:20][CH2:21][CH:22]1[CH2:23][CH2:24][N:25]([CH2:28][CH2:29][C:30]([F:31])([F:32])[F:33])[CH2:26][CH2:27]1

Participants

10

Reactant 9

HCID 923Sodium ion3×HCID 961HydroxideHCID 962WaterHCID 1117Sulfate IonHCID 8028TetrahydrofuranHCID 28486Lithium ionHCID 104727Aluminum CationHCID 166653Hydride4×HCID 235535074-(2-Hydroxy-3-{[1-(3,3,3-trifluoro-propyl)-piperidin-4-ylmethyl]-amino}-propoxy)-fluoren-9-one

Product 1

HCID 235535064-[2-hydroxy-3-[[1-(3,3,3-trifluoropropyl)piperidin-4-yl]methylamino]propoxy]-9H-fluoren-9-ol

Sources & evidence

ORD record
ord-a5b0050a00cd4e4c9ac945c275fdebf7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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