Benzene → HCID 54342442, compound

HRID 171941Notes

Reaction equation

HRID 171941 reaction equation
[C:1](=[O:2])([OH:3])[c:4]1[cH:5][cH:6][c:7]([CH:8]=[C:9]2[C:10](=[O:18])[NH:11][c:12]3[n:13][cH:14][cH:15][cH:16][c:17]32)[cH:19][cH:20]1.[CH3:21][OH:22].[S:23](=[O:24])(=[O:25])([OH:26])[OH:27].[cH:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1>>[C:1](=[O:2])([O:3][CH3:21])[c:4]1[cH:5][cH:6][c:7]([CH:8]=[C:9]2[C:10](=[O:18])[NH:11][c:12]3[n:13][cH:14][cH:15][cH:16][c:17]32)[cH:19][cH:20]1

Participants

5

Reactant 4

HCID 241BenzeneHCID 887MethanolHCID 1118Sulfuric AcidHCID 53957965HCID 53957965, compound

Product 1

HCID 54342442HCID 54342442, compound

Sources & evidence

ORD record
ord-b0b5a8c156114d51bb2f362bb52bc190
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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