Ethylene Glycol → HCID 57165524, compound

HRID 149958Notes

Reaction equation

HRID 149958 reaction equation
[CH2:35]([OH:36])[CH2:37][OH:38].[CH3:1][c:2]1[cH:3][c:4]([CH3:32])[c:5]2[c:6]([n:7]1)[n:8]([CH2:13][c:14]1[cH:15][cH:16][c:17]3[c:18]([cH:31]1)[O:19][CH2:20][c:21]1[c:22]([cH:27][cH:28][cH:29][cH:30]1)[C:23]3=[CH:24][C:25]#[N:26])[c:9]([CH2:11][CH3:12])[n:10]2.[Na+:34].[OH-:33].[OH2:39]>>[CH3:1][c:2]1[cH:3][c:4]([CH3:32])[c:5]2[c:6]([n:7]1)[n:8]([CH2:13][c:14]1[cH:15][cH:16][c:17]3[c:18]([cH:31]1)[O:19][CH2:20][c:21]1[c:22]([cH:27][cH:28][cH:29][cH:30]1)[C:23]3=[CH:24][C:25](=[O:33])[OH:39])[c:9]([CH2:11][CH3:12])[n:10]2

Participants

6

Reactant 5

HCID 174Ethylene GlycolHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 53646903HCID 53646903, compound

Product 1

HCID 57165524HCID 57165524, compound

Sources & evidence

ORD record
ord-5304ea40ba71447bac3c81fc917cfb4d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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