Acetate → HCID 90902105, compound

HRID 125068Notes

Reaction equation

HRID 125068 reaction equation
[C:78]([O-:79])(=[O:80])[CH3:81].[C:83]([O-:84])(=[O:85])[CH3:86].[CH2:54]([CH2:55][CH2:56][CH3:57])[S:58](=[O:59])(=[O:60])[O:61][c:62]1[c:63]([O:71][CH3:72])[cH:64][c:65]([CH2:68][CH:69]=[CH2:70])[cH:66][cH:67]1.[CH3:26][O:27][C:28]([CH:29]=[CH:30][c:31]1[c:32]([O:38][CH2:39][c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:33][c:34]([I:37])[cH:35][cH:36]1)=[O:46].[CH3:47][CH2:48][N:49]([CH2:50][CH3:51])[CH2:52][CH3:53].[CH3:73][N:74]([CH3:75])[CH:76]=[O:77].[CH:1]1([P:2]([CH:3]2[CH2:4][CH2:5][CH2:6][CH2:7][CH2:8]2)[c:9]2[cH:10][cH:11][cH:12][cH:13][c:14]2-[c:15]2[cH:16][cH:17][cH:18][cH:19][cH:20]2)[CH2:21][CH2:22][CH2:23][CH2:24][CH2:25]1.[OH2:87].[Pd+2:82]>>[CH3:26][O:27][C:28]([CH:29]=[CH:30][c:31]1[c:32]([O:38][CH2:39][c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[cH:33][c:34]([CH:70]=[CH:69][CH2:68][c:65]2[cH:64][c:63]([O:71][CH3:72])[c:62]([O:61][S:58]([CH2:54][CH2:55][CH2:56][CH3:57])(=[O:59])=[O:60])[cH:67][cH:66]2)[cH:35][cH:36]1)=[O:46]

Participants

9

Reactant 8

HCID 175Acetate2×HCID 962WaterHCID 6228DimethylformamideHCID 8471TriethylamineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 27342162-(Dicyclohexylphosphino)biphenylHCID 69262141HCID 69262141, compoundHCID 86642396HCID 86642396, compound

Product 1

HCID 90902105HCID 90902105, compound

Sources & evidence

ORD record
ord-ff0bbf421fc34adc9155e601f3b51745
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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