Acetate → HCID 86629645, compound

HRID 1223413Notes

Reaction equation

HRID 1223413 reaction equation
[C:1](#[N:2])[c:3]1[c:4]([O:20][S:21]([C:22]([F:23])([F:24])[F:25])(=[O:26])=[O:27])[c:5]2[c:6]([cH:18][cH:19]1)[CH2:7][CH2:8][N:9]([C:12]([C:13]([F:14])([F:15])[F:16])=[O:17])[CH2:10][CH2:11]2.[C:82](=[O:83])([O-:84])[O-:85].[CH3:88][c:89]1[cH:90][cH:91][cH:92][cH:93][cH:94]1.[Cs+:86].[Cs+:87].[NH2:28][CH2:29][c:30]1[cH:31][cH:32][cH:33][cH:34][cH:35]1.[O-:100][C:101]([CH3:102])=[O:103].[O-:96][C:97]([CH3:98])=[O:99].[Pd+2:95].[cH:36]1[cH:37][cH:38][c:39]([P:40]([c:41]2[cH:42][cH:43][c:44]3[c:45]([cH:46][cH:47][cH:48][cH:49]3)[c:50]2-[c:51]2[c:52]3[c:53]([cH:54][cH:55][cH:56][cH:57]3)[cH:58][cH:59][c:60]2[P:61]([c:62]2[cH:63][cH:64][cH:65][cH:66][cH:67]2)[c:68]2[cH:69][cH:70][cH:71][cH:72][cH:73]2)[c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)[cH:80][cH:81]1>>[C:1](#[N:2])[c:3]1[c:4]([NH:28][CH2:29][c:30]2[cH:31][cH:32][cH:33][cH:34][cH:35]2)[c:5]2[c:6]([cH:18][cH:19]1)[CH2:7][CH2:8][N:9]([C:12]([C:13]([F:14])([F:15])[F:16])=[O:17])[CH2:10][CH2:11]2

Participants

9

Reactant 8

HCID 175Acetate2×HCID 1140TolueneHCID 7504BenzylamineHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 634876Binap, (A+-)-HCID 86629646HCID 86629646, compound

Product 1

HCID 86629645HCID 86629645, compound

Sources & evidence

ORD record
ord-3c641f53622742718bdd2b5cb670ad87
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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