4,4,5,5-Tetramethyl-2-(2-methyl-4-(trifluoromethylsulfonyl)phenyl)-1,3,2-dioxaborolane → Methyl 4-methyl-3-(1-(2-methyl-4-(trifluoromethylsulfonyl)phenyl)phthalazin-6-yl)benzoate

HRID 1124561Notes

Reaction equation

HRID 1124561 reaction equation
[CH3:1][C:2]1([CH3:3])[C:4]([CH3:5])([CH3:6])[O:7][B:8]([c:9]2[c:10]([CH3:22])[cH:11][c:12]([S:15](=[O:16])(=[O:17])[C:18]([F:19])([F:20])[F:21])[cH:13][cH:14]2)[O:23]1.[Cl:24][c:25]1[n:26][n:27][cH:28][c:29]2[cH:30][c:31](-[c:35]3[cH:36][c:37]([C:38](=[O:39])[O:40][CH3:41])[cH:42][cH:43][c:44]3[CH3:45])[cH:32][cH:33][c:34]12>>[c:9]1(-[c:25]2[n:26][n:27][cH:28][c:29]3[cH:30][c:31](-[c:35]4[cH:36][c:37]([C:38](=[O:39])[O:40][CH3:41])[cH:42][cH:43][c:44]4[CH3:45])[cH:32][cH:33][c:34]23)[c:10]([CH3:22])[cH:11][c:12]([S:15](=[O:16])(=[O:17])[C:18]([F:19])([F:20])[F:21])[cH:13][cH:14]1

Participants

3

Reactant 2

HCID 595941864,4,5,5-Tetramethyl-2-(2-methyl-4-(trifluoromethylsulfonyl)phenyl)-1,3,2-dioxaborolaneHCID 77230175Methyl 3-(1-chlorophthalazin-6-yl)-4-methylbenzoate

Product 1

HCID 66674278Methyl 4-methyl-3-(1-(2-methyl-4-(trifluoromethylsulfonyl)phenyl)phthalazin-6-yl)benzoate

Sources & evidence

ORD record
ord-22a75f29ce244a0b97c38db1520ea6cd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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