Dimethylformamide → [4-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-isobenzofuran-5-yl)-2-methyl-but-2-enyloxymethyl]-phosphonic acid diisopropyl ester

HRID 2148385Notes

Reaction equation

HRID 2148385 reaction equation
[Br:21][CH2:22][P:23]([O:24][CH:25]([CH3:26])[CH3:27])([O:28][CH:29]([CH3:30])[CH3:31])=[O:32].[CH3:33][C:34]([CH3:35])([O-:36])[CH3:37].[Li+:38].[O:39]=[CH:40][N:41]([CH3:42])[CH3:43].[OH:1][c:2]1[c:3]([CH2:15][CH:16]=[C:17]([CH2:18][OH:19])[CH3:20])[c:4]([O:13][CH3:14])[c:5]([CH3:12])[c:6]2[c:10]1[C:9](=[O:11])[O:8][CH2:7]2>>[OH:1][c:2]1[c:3]([CH2:15][CH:16]=[C:17]([CH2:18][O:19][CH2:22][P:23]([O:24][CH:25]([CH3:26])[CH3:27])([O:28][CH:29]([CH3:30])[CH3:31])=[O:32])[CH3:20])[c:4]([O:13][CH3:14])[c:5]([CH3:12])[c:6]2[c:10]1[C:9](=[O:11])[O:8][CH2:7]2

Participants

6

Reactant 5

HCID 6228DimethylformamideHCID 28486Lithium ionHCID 30062907-hydroxy-6-(4-hydroxy-3-methyl-but-2-enyl)-5-methoxy-4-methyl-3H-isobenzofuran-1-oneHCID 4366885Diisopropyl bromomethylphosphonateHCID 45749132-Methylpropan-2-olate

Product 1

HCID 76541024[4-(4-Hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-isobenzofuran-5-yl)-2-methyl-but-2-enyloxymethyl]-phosphonic acid diisopropyl ester

Sources & evidence

ORD record
ord-c667fb51d2ff4d37ad6d4166f23dc088
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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