Acetic Acid → 6-Chloro-[1,2,4]triazolo[1,5-a]pyrimidine-2-carbaldehyde

HRID 191053Notes

Reaction equation

HRID 191053 reaction equation
[C:24]([OH:25])(=[O:26])[CH3:27].[C:28]([OH:29])(=[O:30])[CH3:31].[CH3:13][C:14]1([CH3:23])[N:15]([O:16])[C:17]([CH3:18])([CH3:19])[CH2:20][CH2:21][CH2:22]1.[CH3:39][O:40][C:41]([CH3:42])([CH3:43])[CH3:44].[Cl:1][c:2]1[cH:3][n:4][c:5]2[n:6]([cH:7]1)[n:8][c:9]([CH2:11][OH:12])[n:10]2.[Cl:45][CH2:46][Cl:47].[I:32][c:33]1[cH:34][cH:35][cH:36][cH:37][cH:38]1>>[Cl:1][c:2]1[cH:3][n:4][c:5]2[n:6]([cH:7]1)[n:8][c:9]([CH:11]=[O:12])[n:10]2

Participants

7

Reactant 6

HCID 176Acetic Acid2×HCID 6344DichloromethaneHCID 11575IodobenzeneHCID 15413tert-Butyl methyl etherHCID 5499762,2,6,6-Tetramethylpiperidin-1-olHCID 23056782(6-Chloro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)methanol

Product 1

HCID 587625546-Chloro-[1,2,4]triazolo[1,5-a]pyrimidine-2-carbaldehyde

Sources & evidence

ORD record
ord-17fb3e1bdc6a4ab8886e71f3c636d515
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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