Acetate → HCID 178496443, compound

HRID 700820Notes

Reaction equation

HRID 700820 reaction equation
[C:39](=[O:40])([O-:41])[O-:42].[CH3:60][c:61]1[cH:62][cH:63][cH:64][cH:65][cH:66]1.[Cs+:43].[Cs+:44].[F:1][c:2]1[cH:3][c:4]([CH2:8][CH:9]([CH:10]([CH2:11][NH:12][CH:13]2[CH2:14][C:15]3([CH2:16][CH2:17][CH2:18]3)[O:19][c:20]3[c:21]([Cl:31])[n:22][c:23]([CH2:26][C:27]([CH3:28])([CH3:29])[CH3:30])[cH:24][c:25]32)[OH:32])[NH:33][C:34]([CH2:35][O:36][CH3:37])=[O:38])[cH:5][cH:6][cH:7]1.[O-:52][C:53]([CH3:54])=[O:55].[O-:56][C:57]([CH3:58])=[O:59].[OH:45][CH2:46][C:47]([F:48])([F:49])[F:50].[Pd+2:51]>>[F:1][c:2]1[cH:3][c:4]([CH2:8][CH:9]([CH:10]([CH2:11][NH:12][CH:13]2[CH2:14][C:15]3([CH2:16][CH2:17][CH2:18]3)[O:19][c:20]3[c:21]([O:45][CH2:46][C:47]([F:48])([F:49])[F:50])[n:22][c:23]([CH2:26][C:27]([CH3:28])([CH3:29])[CH3:30])[cH:24][c:25]32)[OH:32])[NH:33][C:34]([CH2:35][O:36][CH3:37])=[O:38])[cH:5][cH:6][cH:7]1

Participants

8

Reactant 7

HCID 175Acetate2×HCID 1140TolueneHCID 64092,2,2-TrifluoroethanolHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 178496442HCID 178496442, compound

Product 1

HCID 178496443HCID 178496443, compound

Sources & evidence

ORD record
ord-0e06078c064b4658a6ecfaa4d6b1a160
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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