Acetate → 4-Formyl-1-tosyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid

HRID 2317565Notes

Reaction equation

HRID 2317565 reaction equation
[C:51]([O-:52])(=[O:53])[CH3:54].[C:56]([O-:57])(=[O:58])[CH3:59].[CH3:30][C:31]([O:32][C:33](=[O:34])[CH3:35])=[O:36].[CH3:46][OH:47].[CH:37]([N:38]([CH2:39][CH3:40])[CH:41]([CH3:42])[CH3:43])([CH3:44])[CH3:45].[CH:4](=[O:5])[O-:6].[Cl-:2].[Cl:48][CH2:49][Cl:50].[I:8][c:9]1[cH:10][n:11]([S:20](=[O:21])(=[O:22])[c:23]2[cH:24][cH:25][c:26]([CH3:27])[cH:28][cH:29]2)[c:12]2[n:13][cH:14][cH:15][c:16]([CH:18]=[O:19])[c:17]12.[Li+:1].[Li+:7].[O:60]=[CH:61][N:62]([CH3:63])[CH3:64].[OH2:3].[Pd+2:55]>>[C:4](=[O:5])([OH:6])[c:9]1[cH:10][n:11]([S:20](=[O:21])(=[O:22])[c:23]2[cH:24][cH:25][c:26]([CH3:27])[cH:28][cH:29]2)[c:12]2[n:13][cH:14][cH:15][c:16]([CH:18]=[O:19])[c:17]12

Participants

13

Reactant 12

HCID 175Acetate2×HCID 283FormateHCID 312ChlorideHCID 887MethanolHCID 962WaterHCID 6228DimethylformamideHCID 6344DichloromethaneHCID 7918Acetic AnhydrideHCID 28486Lithium ion2×HCID 81531DiisopropylethylamineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 582934163-Iodo-1-tosyl-1H-pyrrolo[2,3-b]pyridine-4-carbaldehyde

Product 1

HCID 582934364-Formyl-1-tosyl-1H-pyrrolo[2,3-b]pyridine-3-carboxylic acid

Sources & evidence

ORD record
ord-70aa989bdb13456896462c4553ec5721
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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