Acetate → HCID 21886727, compound

HRID 303177Notes

Reaction equation

HRID 303177 reaction equation
[Br:1][c:2]1[cH:3][c:4]([S:8](=[O:9])(=[O:10])[c:11]2[cH:12][c:13]([C:18]#[N:19])[s:14][c:15]2[S:16][CH3:17])[cH:5][cH:6][cH:7]1.[C:72](=[O:73])([O-:74])[O-:75].[CH2:20]1[CH2:21][CH2:22][NH:23][CH2:24][CH2:25]1.[CH3:78][c:79]1[cH:80][cH:81][cH:82][cH:83][cH:84]1.[Cs+:76].[Cs+:77].[O-:86][C:87]([CH3:88])=[O:89].[O-:90][C:91]([CH3:92])=[O:93].[Pd+2:85].[cH:26]1[cH:27][cH:28][c:29]([P:30]([c:31]2[cH:32][cH:33][c:34]3[c:35]([cH:36][cH:37][cH:38][cH:39]3)[c:40]2-[c:41]2[c:42]3[c:43]([cH:44][cH:45][cH:46][cH:47]3)[cH:48][cH:49][c:50]2[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)[c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)[cH:70][cH:71]1>>[c:2]1([N:23]2[CH2:22][CH2:21][CH2:20][CH2:25][CH2:24]2)[cH:3][c:4]([S:8](=[O:9])(=[O:10])[c:11]2[cH:12][c:13]([C:18]#[N:19])[s:14][c:15]2[S:16][CH3:17])[cH:5][cH:6][cH:7]1

Participants

9

Reactant 8

HCID 175Acetate2×HCID 1140TolueneHCID 8082PiperidineHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 634876Binap, (A+-)-HCID 21886036HCID 21886036, compound

Product 1

HCID 21886727HCID 21886727, compound

Sources & evidence

ORD record
ord-0cc15484e8dc46869aa4b8f0959a08e7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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