Bicarbonate Ion → HCID 20142081, compound

Reaction equation

[C:30](=[O:31])([OH:32])[O-:33].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[cH:6][c:7]([O:12][c:13]3[cH:14][cH:15][c:16]([O:17][CH:18]([C:19](=[O:20])[NH2:21])[CH3:22])[cH:23][cH:24]3)[cH:8][n:9][c:10]2[cH:11]1.[Na+:34].[OH2:35].[P:25]([Cl:26])([Cl:27])([Cl:28])=[O:29]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[cH:6][c:7]([O:12][c:13]3[cH:14][cH:15][c:16]([O:17][CH:18]([C:19]#[N:21])[CH3:22])[cH:23][cH:24]3)[cH:8][n:9][c:10]2[cH:11]1

Participants

Reactant 5

HCID 769Bicarbonate Ion

HCID 923Sodium Ion

HCID 962Water

HCID 24813Phosphorus oxychloride

HCID 20142073HCID 20142073, compound

Product 1

HCID 20142081HCID 20142081, compound

Sources & evidence

ORD record: ord-b6cbd3f8d38f419684fdfad91ab7298c
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (6/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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