Ethanol → HCID 10314804, compound

HRID 2320255Notes

Reaction equation

HRID 2320255 reaction equation
[C:1]([O:2][C:3](=[O:4])[n:8]1[c:9](-[c:13]2[cH:14][n:15][c:16]([NH2:29])[c:17]([O:19][CH2:20][c:21]3[c:22]([Cl:28])[cH:23][cH:24][cH:25][c:26]3[Cl:27])[cH:18]2)[cH:10][cH:11][cH:12]1)([CH3:5])([CH3:6])[CH3:7].[CH2:37]([OH:38])[CH3:39].[Na+:30].[Na+:31].[O-:32][C:33](=[O:34])[O-:35].[OH2:36]>>[nH:8]1[c:9](-[c:13]2[cH:14][n:15][c:16]([NH2:29])[c:17]([O:19][CH2:20][c:21]3[c:22]([Cl:28])[cH:23][cH:24][cH:25][c:26]3[Cl:27])[cH:18]2)[cH:10][cH:11][cH:12]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ion2×HCID 962WaterHCID 19660Carbonate IonHCID 10388186HCID 10388186, compound

Product 1

HCID 10314804HCID 10314804, compound

Sources & evidence

ORD record
ord-2caf2186c633416487042b49dd0c8f08
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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