Acetate → HCID 53816732, compound

HRID 1113028Notes

Reaction equation

[C:37]([O-:38])(=[O:39])[CH3:40].[C:42]([O-:43])(=[O:44])[CH3:45].[CH2:12]=[CH:13][C:14]#[N:15].[CH2:16]([N:17]([CH2:18][CH2:19][CH2:20][CH3:21])[CH2:22][CH2:23][CH2:24][CH3:25])[CH2:26][CH2:27][CH3:28].[CH3:1][c:2]1[cH:3][c:4]([C:5]([Cl:6])=[O:7])[cH:8][cH:9][c:10]1[CH3:11].[CH3:29][c:30]1[cH:31][cH:32][c:33]([CH3:34])[cH:35][cH:36]1.[Pd+2:41]>>[CH3:1][c:2]1[cH:3][c:4]([CH:5]=[CH:13][C:14]#[N:15])[cH:8][cH:9][c:10]1[CH3:11]

Participants

Reactant 6

HCID 175Acetate2×

HCID 7622Tributylamine

HCID 7809P-Xylene

HCID 7855Acrylonitrile

HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)

HCID 27585353,4-Dimethylbenzoyl chloride

Product 1

HCID 53816732HCID 53816732, compound

Sources & evidence

ORD record: ord-c45fd2e075b641d1b4c0b44742f64421
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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