Hydrochloric Acid → alpha-[3-[4-(1,2-Benzisoxazol-3-yl)-1-piperazinyl]propyl]-4-fluorobenzenemethanol

HRID 1115260Notes

Reaction equation

[BH4-:29].[CH3:33][CH2:34][OH:35].[ClH:1].[Na+:30].[Na+:32].[OH-:31].[o:2]1[n:3][c:4]([N:11]2[CH2:12][CH2:13][N:14]([CH2:17][CH2:18][CH2:19][C:20](=[O:21])[c:22]3[cH:23][cH:24][c:25]([F:28])[cH:26][cH:27]3)[CH2:15][CH2:16]2)[c:5]2[c:6]1[cH:7][cH:8][cH:9][cH:10]2>>[o:2]1[n:3][c:4]([N:11]2[CH2:12][CH2:13][N:14]([CH2:17][CH2:18][CH2:19][CH:20]([OH:21])[c:22]3[cH:23][cH:24][c:25]([F:28])[cH:26][cH:27]3)[CH2:15][CH2:16]2)[c:5]2[c:6]1[cH:7][cH:8][cH:9][cH:10]2

Participants

Reactant 6

HCID 313Hydrochloric Acid

HCID 702Ethanol

HCID 923Sodium ion2×

HCID 961Hydroxide

HCID 28123Borohydride

HCID 132324884-(4-Benzo[d]isoxazol-3-yl-piperazin-1-yl)-1-(4-fluoro-phenyl)-butan-1-one

Product 1

HCID 13232490alpha-[3-[4-(1,2-Benzisoxazol-3-yl)-1-piperazinyl]propyl]-4-fluorobenzenemethanol

Sources & evidence

ORD record: ord-f2ee787f26e94025b2f187198f2db170
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

Loading…