Ethanol → HCID 53650987, compound

HRID 1222237Notes

Reaction equation

HRID 1222237 reaction equation
[CH3:46][CH2:47][OH:48].[Cl:1][c:2]1[c:3](-[n:22]2[c:23]([CH2:27][NH:28][C:29]([CH:30]=[CH:31][c:32]3[cH:33][n:34][c:35]([C:38](=[O:39])[O:40][CH2:41][CH3:42])[cH:36][cH:37]3)=[O:43])[cH:24][cH:25][cH:26]2)[cH:4][cH:5][c:6]([Cl:21])[c:7]1[CH2:8][O:9][c:10]1[cH:11][cH:12][cH:13][c:14]2[cH:15][cH:16][c:17]([CH3:20])[n:18][c:19]12.[Na+:45].[OH-:44]>>[Cl:1][c:2]1[c:3](-[n:22]2[c:23]([CH2:27][NH:28][C:29]([CH:30]=[CH:31][c:32]3[cH:33][n:34][c:35]([C:38](=[O:39])[OH:40])[cH:36][cH:37]3)=[O:43])[cH:24][cH:25][cH:26]2)[cH:4][cH:5][c:6]([Cl:21])[c:7]1[CH2:8][O:9][c:10]1[cH:11][cH:12][cH:13][c:14]2[cH:15][cH:16][c:17]([CH3:20])[n:18][c:19]12

Participants

5

Reactant 4

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 53983163HCID 53983163, compound

Product 1

HCID 53650987HCID 53650987, compound

Sources & evidence

ORD record
ord-d91da5ff901d4041aad380535a6ab8ee
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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