Acetate → 2-Methyl-7-phenyl-1-indanone

HRID 1238098Notes

Reaction equation

HRID 1238098 reaction equation
[C:28]([O-:29])(=[O:30])[CH3:31].[C:33]([O-:34])(=[O:35])[CH3:36].[Cl:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[c:10]1[C:9](=[O:11])[CH:8]([CH3:12])[CH2:7]2.[Na+:22].[Na+:23].[O-:24][C:25](=[O:26])[O-:27].[OH2:37].[OH:13][B:14]([OH:15])[c:16]1[cH:17][cH:18][cH:19][cH:20][cH:21]1.[Pd+2:32]>>[c:2]1(-[c:16]2[cH:17][cH:18][cH:19][cH:20][cH:21]2)[cH:3][cH:4][cH:5][c:6]2[c:10]1[C:9](=[O:11])[CH:8]([CH3:12])[CH2:7]2

Participants

8

Reactant 7

HCID 175Acetate2×HCID 923Sodium ion2×HCID 962WaterHCID 19660Carbonate IonHCID 66827Phenylboronic AcidHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 117898227-Chloro-2-methyl-2,3-dihydro-1H-inden-1-one

Product 1

HCID 185126012-Methyl-7-phenyl-1-indanone

Sources & evidence

ORD record
ord-e7e598bd54b24da38c4a447cc1c9f20f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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