Acetate → HCID 57863417, compound

HRID 683250Notes

Reaction equation

HRID 683250 reaction equation
[C:35]([CH3:36])(=[O:37])[NH2:38].[C:39](=[O:40])([O-:41])[O-:42].[C:47]([O-:48])(=[O:49])[CH3:50].[C:52]([O-:53])(=[O:54])[CH3:55].[CH3:1][O:2][CH2:3][CH2:4][NH:5][C:6](=[O:7])[c:8]1[n:9][c:10]([I:34])[c:11]2[cH:12][c:13]([CH2:26][c:27]3[cH:28][cH:29][c:30]([F:33])[cH:31][cH:32]3)[cH:14][n:15][c:16]2[c:17]1[O:18][CH2:19][c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1.[CH3:57][CH2:58][O:59][C:60](=[O:61])[CH3:62].[Cl-:45].[Cs+:43].[Cs+:44].[NH4+:46].[O:63]1[CH2:64][CH2:65][O:66][CH2:67][CH2:68]1.[OH2:56].[Pd+2:51]>>[CH3:1][O:2][CH2:3][CH2:4][NH:5][C:6](=[O:7])[c:8]1[n:9][c:10]([NH:38][C:35]([CH3:36])=[O:37])[c:11]2[cH:12][c:13]([CH2:26][c:27]3[cH:28][cH:29][c:30]([F:33])[cH:31][cH:32]3)[cH:14][n:15][c:16]2[c:17]1[O:18][CH2:19][c:20]1[cH:21][cH:22][cH:23][cH:24][cH:25]1

Participants

12

Reactant 11

HCID 175Acetate2×HCID 178AcetamideHCID 223AmmoniumHCID 312ChlorideHCID 962WaterHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 59696213HCID 59696213, compound

Product 1

HCID 57863417HCID 57863417, compound

Sources & evidence

ORD record
ord-758b444c0c504d0491901b0d732fa270
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

Loading…