Benzene → HCID 19423963, compound

HRID 309420Notes

Reaction equation

HRID 309420 reaction equation
[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([CH:15]=[CH:16][c:17]2[cH:18][c:19]([Cl:23])[cH:20][cH:21][cH:22]2)[cH:11][cH:12][cH:13][cH:14]1.[CH3:46][CH2:47][OH:48].[H:24][H:25].[Na+:26].[Na+:38].[Na+:39].[OH:27][S:28](=[O:29])[O-:30].[S:31]([S:32]([O-:33])=[O:34])([O-:35])(=[O:36])=[O:37].[cH:40]1[cH:41][cH:42][cH:43][cH:44][cH:45]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[c:10]([CH2:15][CH2:16][c:17]2[cH:18][c:19]([Cl:23])[cH:20][cH:21][cH:22]2)[cH:11][cH:12][cH:13][cH:14]1

Participants

8

Reactant 7

HCID 241BenzeneHCID 702EthanolHCID 923Sodium ion3×HCID 104748BisulfiteHCID 159940DisulfiteHCID 54207945HCID 54207945, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 19423963HCID 19423963, compound

Sources & evidence

ORD record
ord-f0dd35a9f5704a899d61db9109ee2733
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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