Ethanol → HCID 22915630, compound

HRID 1561074Notes

Reaction equation

HRID 1561074 reaction equation
[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6]([CH2:13][c:14]2[cH:15][c:16]3[cH:17][cH:18][c:19](-[c:24]4[c:25]([C:26](=[O:27])[O:28][CH3:29])[cH:30][cH:31][cH:32][cH:33]4)[n:20][c:21]3[cH:22][cH:23]2)[c:7]([CH:11]=[O:12])[c:8]([Cl:10])[n:9]1.[CH3:37][CH2:38][OH:39].[Na+:35].[OH-:34].[OH2:36]>>[CH2:1]([CH2:2][CH2:3][CH3:4])[c:5]1[n:6]([CH2:13][c:14]2[cH:15][c:16]3[cH:17][cH:18][c:19](-[c:24]4[c:25]([C:26](=[O:27])[OH:28])[cH:30][cH:31][cH:32][cH:33]4)[n:20][c:21]3[cH:22][cH:23]2)[c:7]([CH:11]=[O:12])[c:8]([Cl:10])[n:9]1

Participants

6

Reactant 5

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 15816899HCID 15816899, compound

Product 1

HCID 22915630HCID 22915630, compound

Sources & evidence

ORD record
ord-72a12958721a4561a15fa7d94af2d91d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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