Acetate → 7-Methyl-9-(3-(phenyl)propoxy)-5H-furo[3,2-g]chromen-5-one

HRID 177097Notes

Reaction equation

HRID 177097 reaction equation
[CH2:36]([NH+:37]([CH2:38][CH3:39])[CH2:40][CH3:41])[CH3:42].[CH3:43][CH2:44][N:45]([CH2:46][CH3:47])[CH2:48][CH3:49].[CH3:69][N:70]([CH3:71])[CH:72]=[O:73].[CH:33]([O-:34])=[O:35].[O-:75][C:76]([CH3:77])=[O:78].[O-:79][C:80]([CH3:81])=[O:82].[Pd+2:74].[c:1]1([CH2:7][CH2:8][CH2:9][O:10][c:11]2[c:12]3[c:13]([c:14]([S:23]([C:24]([F:25])([F:26])[F:27])(=[O:28])=[O:29])[c:15]4[c:16](=[O:22])[cH:17][c:18]([CH3:21])[o:19][c:20]24)[cH:30][cH:31][o:32]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1.[c:50]1([P:51]([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[cH:64][cH:65][cH:66][cH:67][cH:68]1>>[c:1]1([CH2:7][CH2:8][CH2:9][O:10][c:11]2[c:12]3[c:13]([cH:14][c:15]4[c:16](=[O:22])[cH:17][c:18]([CH3:21])[o:19][c:20]24)[cH:30][cH:31][o:32]3)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

9

Reactant 8

HCID 175Acetate2×HCID 283FormateHCID 6228DimethylformamideHCID 8471TriethylamineHCID 11776TriphenylphosphineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 1385867TriethylammoniumHCID 687138709-(3-Phenylpropoxy)-7-methyl-4-trifluoromethanesulfonyl-5H-furo[3,2-g]chromen-5-one

Product 1

HCID 592724047-Methyl-9-(3-(phenyl)propoxy)-5H-furo[3,2-g]chromen-5-one

Sources & evidence

ORD record
ord-1a6b3a9caee74abf99478f2467dcfd3f
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

Loading…