Acetate → (2,4-Dimethyl-phenyl)-phosphonic acid dimethyl ester

HRID 689949

Reaction equation

HRID 689949 reaction equation
[C:20]([O-:21])(=[O:22])[CH3:23].[C:25]([O-:26])(=[O:27])[CH3:28].[CH3:17][C:18]#[N:19].[I:1][c:2]1[c:3]([CH3:9])[cH:4][c:5]([CH3:8])[cH:6][cH:7]1.[P:10]([O:11][CH3:12])([O:13][CH3:14])[O:15][CH3:16].[Pd+2:24]>>[c:2]1([P:10]([O:11][CH3:12])([O:13][CH3:14])=[O:15])[c:3]([CH3:9])[cH:4][c:5]([CH3:8])[cH:6][cH:7]1

Participants

6

Reactant 5

HCID 175Acetate2×HCID 6342AcetonitrileHCID 8472Trimethyl phosphiteHCID 778854-Iodo-m-xyleneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)

Product 1

HCID 13836142(2,4-Dimethyl-phenyl)-phosphonic acid dimethyl ester

Sources & evidence

ORD record
ord-a53eb05c04664bfd8ab1782df4ffd762
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Linked notes

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