1,2-Dichloroethane → 5,7-Dihydroxy-8-acetyl-4-propyl-coumarin

HRID 185015Notes

Reaction equation

HRID 185015 reaction equation
[CH3:26][C:27](=[O:28])[O:29][C:30](=[O:31])[CH3:32].[Cl:33][CH2:34][CH2:35][Cl:36].[O-:17][N+:18]([c:19]1[cH:20][cH:21][cH:22][cH:23][cH:24]1)=[O:25].[OH:1][c:2]1[c:3]2[c:4]([CH2:14][CH2:15][CH3:16])[cH:5][c:6](=[O:13])[o:7][c:8]2[cH:9][c:10]([OH:12])[cH:11]1>>[OH:1][c:2]1[c:3]2[c:4]([CH2:14][CH2:15][CH3:16])[cH:5][c:6](=[O:13])[o:7][c:8]2[c:9]([C:27]([CH3:26])=[O:28])[c:10]([OH:12])[cH:11]1

Participants

5

Reactant 4

HCID 111,2-DichloroethaneHCID 7416NitrobenzeneHCID 7918Acetic AnhydrideHCID 53912605,7-Dihydroxy-4-propylcoumarin

Product 1

HCID 129682825,7-Dihydroxy-8-acetyl-4-propyl-coumarin

Sources & evidence

ORD record
ord-60767c112f744fcc97d484e70a314570
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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