Acetic Acid → HCID 23005248, compound

HRID 1566374Notes

Reaction equation

HRID 1566374 reaction equation
[Ba+2:43].[CH3:28][C:29](=[O:30])[OH:31].[CH3:32][CH2:33][O:34][C:35](=[O:36])[CH3:37].[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([C:14]([CH2:15][CH2:16][C:17](=[O:18])[OH:19])=[O:20])[cH:12][cH:13]2)[cH:6][cH:7]1.[H:26][H:27].[P:21](=[O:22])([OH:23])([OH:24])[OH:25].[Pd+2:44].[S:38]([O-:39])([O-:40])(=[O:41])=[O:42].[S:45]([O-:46])([O-:47])(=[O:48])=[O:49]>>[Cl:1][c:2]1[cH:3][cH:4][c:5](-[c:8]2[cH:9][cH:10][c:11]([CH2:14][CH2:15][CH2:16][C:17](=[O:18])[OH:19])[cH:12][cH:13]2)[cH:6][cH:7]1

Participants

9

Reactant 8

HCID 176Acetic AcidHCID 1004Phosphoric AcidHCID 1117Sulfate Ion2×HCID 8857Ethyl AcetateHCID 104810Barium ionHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 14116665HCID 14116665, compoundHCID 178418361HCID 178418361, compound

Product 1

HCID 23005248HCID 23005248, compound

Sources & evidence

ORD record
ord-fb970bc23ed643168c37b64f6b5cea57
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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