Benzene → HCID 21317054, compound

HRID 2158950Notes

Reaction equation

HRID 2158950 reaction equation
[C:26](=[O:27])([OH:28])[O-:29].[CH3:21][OH:22].[CH3:23][O-:24].[Cl:1][c:2]1[cH:3][c:4]([CH3:20])[c:5]([NH:12][S:13](=[O:14])(=[O:15])[NH:16][CH:17]([CH3:18])[CH3:19])[c:6]([C:7](=[O:8])[O:9][CH3:10])[cH:11]1.[Na+:25].[Na+:30].[OH2:37].[cH:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1>>[Cl:1][c:2]1[cH:3][c:4]([CH3:20])[c:5]2[c:6]([cH:11]1)[C:7](=[O:8])[N:16]([CH:17]([CH3:18])[CH3:19])[S:13](=[O:14])(=[O:15])[NH:12]2

Participants

8

Reactant 7

HCID 241BenzeneHCID 769Bicarbonate IonHCID 887MethanolHCID 923Sodium ion2×HCID 962WaterHCID 3826051MethoxideHCID 21317050HCID 21317050, compound

Product 1

HCID 21317054HCID 21317054, compound

Sources & evidence

ORD record
ord-6d779d80ffca4ff6b329277440d7da3d
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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