Ethanol → HCID 19428157, compound

HRID 1220565Notes

Reaction equation

HRID 1220565 reaction equation
[CH2:40]([OH:41])[CH3:42].[CH3:34][CH2:35][S:36]([OH:37])(=[O:38])=[O:39].[CH:44]([Cl:45])([Cl:46])[Cl:47].[Na+:33].[OH-:32].[OH2:43].[OH:1][c:2]1[c:3]([O:30][CH3:31])[cH:4][c:5]2[c:6]([c:7]([CH3:28])[c:8]([CH2:12][CH2:13][N:14]3[CH2:15][CH2:16][N:17]([c:20]4[c:21]([O:26][CH3:27])[cH:22][cH:23][cH:24][cH:25]4)[CH2:18][CH2:19]3)[c:9](=[O:11])[o:10]2)[cH:29]1>>[O:1]([c:2]1[c:3]([O:30][CH3:31])[cH:4][c:5]2[c:6]([c:7]([CH3:28])[c:8]([CH2:12][CH2:13][N:14]3[CH2:15][CH2:16][N:17]([c:20]4[c:21]([O:26][CH3:27])[cH:22][cH:23][cH:24][cH:25]4)[CH2:18][CH2:19]3)[c:9](=[O:11])[o:10]2)[cH:29]1)[S:36]([CH2:35][CH3:34])(=[O:37])=[O:38]

Participants

8

Reactant 7

HCID 702EthanolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 6212ChloroformHCID 11668Ethanesulfonic acidHCID 19428170HCID 19428170, compound

Product 1

HCID 19428157HCID 19428157, compound

Sources & evidence

ORD record
ord-03821715fc3f4804b8757eb7620eb6c5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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