Acetate → HCID 67975593, compound

HRID 165649Notes

Reaction equation

HRID 165649 reaction equation
[C:55](=[O:56])([O-:57])[O-:58].[C:68](=[O:69])([O-:70])[O-:71].[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[n:7][n:8]2[c:9]([c:15]1[I:16])[C:10](=[O:14])[NH:11][CH2:12][CH2:13]2.[CH3:17][B:18]([OH:19])[OH:20].[CH3:61][c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1.[CH:21]1([P:22]([CH:23]2[CH2:24][CH2:25][CH2:26][CH2:27][CH2:28]2)[c:29]2[cH:30][cH:31][cH:32][cH:33][c:34]2-[c:35]2[c:36]([CH:37]([CH3:38])[CH3:39])[cH:40][c:41]([CH:42]([CH3:43])[CH3:44])[cH:45][c:46]2[CH:47]([CH3:48])[CH3:49])[CH2:50][CH2:51][CH2:52][CH2:53][CH2:54]1.[K+:59].[K+:60].[Na+:72].[Na+:73].[O-:75][C:76]([CH3:77])=[O:78].[O-:79][C:80]([CH3:81])=[O:82].[Pd+2:74]>>[CH2:1]([CH3:2])[O:3][C:4](=[O:5])[c:6]1[n:7][n:8]2[c:9]([c:15]1[CH3:17])[C:10](=[O:14])[NH:11][CH2:12][CH2:13]2

Participants

10

Reactant 9

HCID 175Acetate2×HCID 813Potassium Cation2×HCID 923Sodium ion2×HCID 1140TolueneHCID 19660Carbonate Ion2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 139377Methylboronic AcidHCID 111557942-Dicyclohexylphosphino-2',4',6'-triisoprophylbiphenylHCID 679916203-Iodo-4-oxo-4,5,6,7-tetrahydro-pyrazolo[1,5-a]pyrazine-2-carboxylic acid ethyl ester

Product 1

HCID 67975593HCID 67975593, compound

Sources & evidence

ORD record
ord-1cb1037cb4354ddd8e1a8a9a42a297ca
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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