Acetate → 3-(4-Formyl-2,6-dimethyl-phenyl)-acrylic acid methyl ester

HRID 687455Notes

Reaction equation

HRID 687455 reaction equation
[C:26]([CH:27]=[CH2:28])(=[O:29])[O:30][CH3:31].[CH3:19][CH2:20][N:21]([CH2:22][CH3:23])[CH2:24][CH3:25].[CH3:66][CH2:67][O:68][CH2:69][CH3:70].[CH:1](=[O:2])[c:3]1[cH:4][c:5]([CH3:18])[c:6]([O:10][S:11]([C:12]([F:13])([F:14])[F:15])(=[O:16])=[O:17])[c:7]([CH3:9])[cH:8]1.[O-:72][C:73]([CH3:74])=[O:75].[O-:76][C:77]([CH3:78])=[O:79].[O:61]=[CH:62][N:63]([CH3:64])[CH3:65].[Pd+2:71].[c:32]1([P:33]([c:34]2[cH:35][cH:36][cH:37][cH:38][cH:39]2)[CH2:40][CH2:41][CH2:42][P:43]([c:44]2[cH:45][cH:46][cH:47][cH:48][cH:49]2)[c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)[cH:56][cH:57][cH:58][cH:59][cH:60]1>>[CH:1](=[O:2])[c:3]1[cH:4][c:5]([CH3:18])[c:6]([CH:28]=[CH:27][C:26](=[O:29])[O:30][CH3:31])[c:7]([CH3:9])[cH:8]1

Participants

9

Reactant 8

HCID 175Acetate2×HCID 3283Diethyl EtherHCID 6228DimethylformamideHCID 7294Methyl AcrylateHCID 8471TriethylamineHCID 812191,3-Bis(diphenylphosphino)propaneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 544771104-Formyl-2,6-dimethylphenyl trifluoromethanesulfonate

Product 1

HCID 765393073-(4-Formyl-2,6-dimethyl-phenyl)-acrylic acid methyl ester

Sources & evidence

ORD record
ord-2f4ffb2fcbac41cbb634bc2977b14081
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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