Acetate → HCID 9926463, compound

HRID 2134286Notes

Reaction equation

HRID 2134286 reaction equation
[Br:1][c:2]1[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8]([O:11][CH3:12])[cH:9][cH:10]1.[C:13](=[O:14])([O-:15])[O-:16].[C:40]([O-:41])(=[O:42])[CH3:43].[C:45]([O-:46])(=[O:47])[CH3:48].[CH3:30][C:31](=[O:32])[OH:33].[Cu+2:44].[K+:17].[K+:18].[NH2:19][c:20]1[cH:21][c:22]([C:26]([CH3:27])([CH3:28])[CH3:29])[n:23][n:24]1[CH3:25].[O:34]=[CH:35][N:36]([CH3:37])[CH3:38].[OH2:39]>>[c:2]1([NH:19][c:20]2[cH:21][c:22]([C:26]([CH3:27])([CH3:28])[CH3:29])[n:23][n:24]2[CH3:25])[c:3]([C:4](=[O:5])[OH:6])[cH:7][c:8]([O:11][CH3:12])[cH:9][cH:10]1

Participants

10

Reactant 9

HCID 175Acetate2×HCID 176Acetic AcidHCID 813Potassium Cation2×HCID 962WaterHCID 6228DimethylformamideHCID 19660Carbonate IonHCID 27099Cupric cationHCID 899062-Bromo-5-methoxybenzoic acidHCID 27352873-tert-Butyl-1-methyl-1H-pyrazol-5-amine

Product 1

HCID 9926463HCID 9926463, compound

Sources & evidence

ORD record
ord-ccce6ba8463442788207eaab51e11c9c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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