Acetate → HCID 54507292, compound

HRID 101440Notes

Reaction equation

HRID 101440 reaction equation
[C:37]([CH:38]=[CH2:39])(=[O:40])[O:41][CH2:42][CH3:43].[C:76]([O-:77])(=[O:78])[CH3:79].[C:81]([O-:82])(=[O:83])[CH3:84].[CH3:44][CH2:45][N:46]([CH2:47][CH3:48])[CH2:49][CH3:50].[CH3:73][C:74]#[N:75].[O:1]1[CH2:2][O:3][c:4]2[c:5]1[cH:6][cH:7][c:8]([CH:10]([C:11](=[O:12])[NH:13][S:14](=[O:15])(=[O:16])[c:17]1[cH:18][cH:19][c:20]([CH:23]([CH3:24])[CH3:25])[cH:21][cH:22]1)[c:26]1[cH:27][n:28]([CH3:36])[c:29]3[cH:30][c:31]([Br:35])[cH:32][cH:33][c:34]13)[cH:9]2.[Pd+2:80].[c:51]1([CH3:52])[cH:53][cH:54][cH:55][cH:56][c:57]1[P:58]([c:59]1[cH:60][cH:61][cH:62][cH:63][c:64]1[CH3:65])[c:66]1[cH:67][cH:68][cH:69][cH:70][c:71]1[CH3:72]>>[O:1]1[CH2:2][O:3][c:4]2[c:5]1[cH:6][cH:7][c:8]([CH:10]([C:11](=[O:12])[NH:13][S:14](=[O:15])(=[O:16])[c:17]1[cH:18][cH:19][c:20]([CH:23]([CH3:24])[CH3:25])[cH:21][cH:22]1)[c:26]1[cH:27][n:28]([CH3:36])[c:29]3[cH:30][c:31]([CH:39]=[CH:38][C:37](=[O:40])[O:41][CH2:42][CH3:43])[cH:32][cH:33][c:34]13)[cH:9]2

Participants

8

Reactant 7

HCID 175Acetate2×HCID 6342AcetonitrileHCID 8471TriethylamineHCID 8821Ethyl AcrylateHCID 80271Tri-o-tolylphosphineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 22467214HCID 22467214, compound

Product 1

HCID 54507292HCID 54507292, compound

Sources & evidence

ORD record
ord-68999bef627246e69ee49f64147109e5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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