Acetate → 2,3-dimethyl-7-(2,4,6-trimethyl-phenyl)-2H-indazole

HRID 2128479Notes

Reaction equation

HRID 2128479 reaction equation
[Br:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[c:7]([CH3:12])[n:8]([CH3:11])[n:9][c:10]12.[CH3:13][c:14]1[c:15]([B:22]([OH:23])[OH:24])[c:16]([CH3:21])[cH:17][c:18]([CH3:20])[cH:19]1.[CH:33]1([P:34]([CH:35]2[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]2)[c:41]2[cH:42][cH:43][cH:44][cH:45][c:46]2-[c:47]2[cH:48][cH:49][cH:50][cH:51][c:52]2[N:53]([CH3:54])[CH3:55])[CH2:56][CH2:57][CH2:58][CH2:59][CH2:60]1.[K+:30].[K+:31].[K+:32].[O-:62][C:63]([CH3:64])=[O:65].[O-:66][C:67]([CH3:68])=[O:69].[P:25]([O-:26])([O-:27])([O-:28])=[O:29].[Pd+2:61]>>[c:2]1(-[c:15]2[c:14]([CH3:13])[cH:19][c:18]([CH3:20])[cH:17][c:16]2[CH3:21])[cH:3][cH:4][cH:5][c:6]2[c:7]([CH3:12])[n:8]([CH3:11])[n:9][c:10]12

Participants

8

Reactant 7

HCID 175Acetate2×HCID 813Potassium Cation3×HCID 1061PhosphateHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 2921842,4,6-Trimethylbenzeneboronic acidHCID 27342172-(Dicyclohexylphosphino)-2'-(dimethylamino)biphenylHCID 441194737-Bromo-2,3-dimethyl-2H-indazole

Product 1

HCID 588610082,3-dimethyl-7-(2,4,6-trimethyl-phenyl)-2H-indazole

Sources & evidence

ORD record
ord-6d4d9313fa974aed986b5955453bafa6
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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