Acetate → 1-Phenylpyrrolidin-2-one

HRID 296438Notes

Reaction equation

HRID 296438 reaction equation
[Br:1][c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1.[C:60](=[O:61])([O-:62])[O-:63].[CH3:75][c:76]1[cH:77][cH:78][cH:79][cH:80][cH:81]1.[Cs+:64].[Cs+:65].[O-:67][C:68]([CH3:69])=[O:70].[O-:71][C:72]([CH3:73])=[O:74].[O:8]=[C:9]1[CH2:10][CH2:11][CH2:12][NH:13]1.[Pd+2:66].[cH:14]1[cH:15][cH:16][c:17]([P:18]([c:19]2[cH:20][cH:21][c:22]3[c:23]([cH:24][cH:25][cH:26][cH:27]3)[c:28]2-[c:29]2[c:30]3[c:31]([cH:32][cH:33][cH:34][cH:35]3)[cH:36][cH:37][c:38]2[P:39]([c:40]2[cH:41][cH:42][cH:43][cH:44][cH:45]2)[c:46]2[cH:47][cH:48][cH:49][cH:50][cH:51]2)[c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)[cH:58][cH:59]1>>[c:2]1([N:13]2[C:9](=[O:8])[CH2:10][CH2:11][CH2:12]2)[cH:3][cH:4][cH:5][cH:6][cH:7]1

Participants

9

Reactant 8

HCID 175Acetate2×HCID 1140TolueneHCID 7961BromobenzeneHCID 120252-PyrrolidoneHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 634876Binap, (A+-)-

Product 1

HCID 783751-Phenylpyrrolidin-2-one

Sources & evidence

ORD record
ord-f31c3bf6587046c3b6785b097feeed17
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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