Hydrochloric Acid → 4-(4-Butoxy-2,3-difluorophenyl)-4'-propylbicyclohexyl-4-ol

HRID 680857

Reaction equation

[CH2:19]([CH2:20][CH3:21])[CH:22]1[CH2:23][CH2:24][CH:25]([CH:28]2[CH2:29][CH2:30][C:31](=[O:34])[CH2:32][CH2:33]2)[CH2:26][CH2:27]1.[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][c:6]1[c:7]([F:13])[c:8]([F:12])[cH:9][cH:10][cH:11]1.[CH2:36]1[O:37][CH2:38][CH2:39][CH2:40]1.[CH3:14][CH2:15][CH2:16][CH2:17][Li:18].[ClH:35]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[O:5][c:6]1[c:7]([F:13])[c:8]([F:12])[c:9]([C:31]2([OH:34])[CH2:30][CH2:29][CH:28]([CH:25]3[CH2:24][CH2:23][CH:22]([CH2:19][CH2:20][CH3:21])[CH2:27][CH2:26]3)[CH2:33][CH2:32]2)[cH:10][cH:11]1

Participants

Reactant 5

HCID 313Hydrochloric Acid

HCID 8028Tetrahydrofuran

HCID 27829391-Butoxy-2,3-Difluorobenzene

HCID 4354185[1,1'-Bicyclohexyl]-4-one,4'-propyl-,

HCID 178418339Butyllithium

Product 1

HCID 589918854-(4-Butoxy-2,3-difluorophenyl)-4'-propylbicyclohexyl-4-ol

Sources & evidence

ORD record: ord-7c50d5e9baf94dc2afa673a69599eace
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

Linked notes

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