Ethylene Glycol → HCID 18455590, compound

HRID 159748Notes

Reaction equation

HRID 159748 reaction equation
[Br:1][c:2]1[cH:3][cH:4][c:5]([N:10]2[CH2:11][CH:12]([CH3:17])[O:13][CH:14]([CH3:16])[CH2:15]2)[c:6]([CH:7]=[O:8])[cH:9]1.[CH3:39][c:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1.[Na+:38].[O-:34][C:35]([OH:36])=[O:37].[OH2:18].[OH:30][CH2:31][CH2:32][OH:33].[c:19]1([CH3:20])[c:21]([S:22]([OH:23])(=[O:24])=[O:25])[cH:26][cH:27][cH:28][cH:29]1>>[Br:1][c:2]1[cH:3][cH:4][c:5]([N:10]2[CH2:11][CH:12]([CH3:17])[O:13][CH:14]([CH3:16])[CH2:15]2)[c:6]([CH:7]2[O:8][CH2:32][CH2:31][O:30]2)[cH:9]1

Participants

8

Reactant 7

HCID 174Ethylene GlycolHCID 769Bicarbonate IonHCID 923Sodium ionHCID 962WaterHCID 1140TolueneHCID 69252-Methylbenzenesulfonic acidHCID 18455603HCID 18455603, compound

Product 1

HCID 18455590HCID 18455590, compound

Sources & evidence

ORD record
ord-635dd6866f3642b1bcc994e121277de7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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