Ethanol → Sodium ion

HRID 1137808Notes

Reaction equation

HRID 1137808 reaction equation
[CH3:1][c:2]1[c:3]([NH:11][c:12]2[n:13][cH:14][c:15]([C:24](=[O:25])[O:26][CH2:27][CH3:28])[c:16](-[c:18]3[cH:19][n:20][cH:21][cH:22][cH:23]3)[n:17]2)[cH:4][c:5]([N+:8](=[O:9])[O-:10])[cH:6][cH:7]1.[CH3:35][CH2:36][OH:37].[Na+:29].[Na+:30].[O-:31][C:32](=[O:33])[O-:34].[OH2:38]>>[CH3:1][c:2]1[c:3]([NH:11][c:12]2[n:13][cH:14][c:15]([C:24](=[O:25])[O-:26])[c:16](-[c:18]3[cH:19][n:20][cH:21][cH:22][cH:23]3)[n:17]2)[cH:4][c:5]([N+:8](=[O:9])[O-:10])[cH:6][cH:7]1.[Na+:29]

Participants

7

Reactant 5

HCID 702EthanolHCID 923Sodium ion2×HCID 962WaterHCID 19660Carbonate IonHCID 592536665-Pyrimidinecarboxylic acid, 2-[(2-methyl-5-nitrophenyl)amino]-4-(3-pyridinyl)-, ethyl ester

Product 2

HCID 923Sodium ionHCID 178426702HCID 178426702, compound

Sources & evidence

ORD record
ord-7ef20bf7283c43899d131747c211134f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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