Bicarbonate Ion → 7-Chloro-2-(2-chlorophenyl)-pyrazolo[1,5-a]pyrimidine

HRID 168018Notes

Reaction equation

HRID 168018 reaction equation
[C:30](=[O:31])([OH:32])[O-:33].[CH3:18][CH2:19][N:20]([CH2:21][CH3:22])[CH2:23][CH3:24].[CH3:35][c:36]1[cH:37][cH:38][cH:39][cH:40][cH:41]1.[CH3:42][CH2:43][O:44][C:45](=[O:46])[CH3:47].[Cl:1][c:2]1[c:3](-[c:8]2[n:9][n:10]3[c:11]([nH:12][cH:13][cH:14][c:15]3=[O:16])[cH:17]2)[cH:4][cH:5][cH:6][cH:7]1.[Na+:34].[P:25]([Cl:26])([Cl:27])([Cl:28])=[O:29]>>[Cl:1][c:2]1[c:3](-[c:8]2[n:9][n:10]3[c:11]([n:12][cH:13][cH:14][c:15]3[Cl:27])[cH:17]2)[cH:4][cH:5][cH:6][cH:7]1

Participants

8

Reactant 7

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 1140TolueneHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 24813Phosphorus oxychlorideHCID 178516531HCID 178516531, compound

Product 1

HCID 210837197-Chloro-2-(2-chlorophenyl)-pyrazolo[1,5-a]pyrimidine

Sources & evidence

ORD record
ord-bd0eac67a51244daa3d833169f2a69b8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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