Acetate → (2'-Chloro-3-methylbiphenyl-4-yl)methanol

HRID 696737Notes

Reaction equation

HRID 696737 reaction equation
[Br:1][c:2]1[cH:3][c:4]([CH3:10])[c:5]([CH2:8][OH:9])[cH:6][cH:7]1.[C:21](=[O:22])([O-:23])[O-:24].[C:51]([O-:52])(=[O:53])[CH3:54].[C:56]([O-:57])(=[O:58])[CH3:59].[CH2:27]([OH:28])[CH2:29][CH3:30].[Cl:11][c:12]1[c:13]([B:18]([OH:19])[OH:20])[cH:14][cH:15][cH:16][cH:17]1.[Na+:25].[Na+:26].[OH2:31].[Pd+2:55].[c:32]1([P:33]([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:46][cH:47][cH:48][cH:49][cH:50]1>>[c:2]1(-[c:13]2[c:12]([Cl:11])[cH:17][cH:16][cH:15][cH:14]2)[cH:3][c:4]([CH3:10])[c:5]([CH2:8][OH:9])[cH:6][cH:7]1

Participants

10

Reactant 9

HCID 175Acetate2×HCID 923Sodium ion2×HCID 962WaterHCID 10311-PropanolHCID 11776TriphenylphosphineHCID 19660Carbonate IonHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 27343222-Chlorophenylboronic acidHCID 22280088(4-Bromo-2-methylphenyl)methanol

Product 1

HCID 67448566(2'-Chloro-3-methylbiphenyl-4-yl)methanol

Sources & evidence

ORD record
ord-d7e3063fdf414a84a3f617afa2cca426
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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