Acetic Acid → HCID 178502005, compound

Reaction equation

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

Participants

Reactant 5

HCID 176Acetic Acid

HCID 702Ethanol

HCID 961Hydroxide2×

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

HCID 178502007HCID 178502007, compound

Product 1

HCID 178502005HCID 178502005, compound

Sources & evidence

ORD record: ord-7d43096d437348abb6a9ec5741184e6c
Source dataset: Training data from https://doi.org/10.1039/C8SC04228D (3/10)
DOI: 10.1039/C8SC04228D

Reaction notes

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