Acetate → HCID 23508412, compound

HRID 1558020Notes

Reaction equation

HRID 1558020 reaction equation
[Br-:29].[Br:1][c:2]1[c:3]([CH2:8][C:9]#[N:10])[cH:4][cH:5][cH:6][cH:7]1.[C:47]([O-:48])(=[O:49])[CH3:50].[C:52]([O-:53])(=[O:54])[CH3:55].[CH3:11][O:12][c:13]1[cH:14][cH:15][c:16]([B:19]([OH:20])[OH:21])[cH:17][cH:18]1.[CH3:23][C:24](=[O:25])[O-:26].[CH3:30][CH2:31][CH2:32][CH2:33][N+:34]([CH2:35][CH2:36][CH2:37][CH3:38])([CH2:39][CH2:40][CH2:41][CH3:42])[CH2:43][CH2:44][CH2:45][CH3:46].[Cl-:28].[K+:22].[Na+:27].[OH2:56].[Pd+2:51]>>[c:2]1(-[c:16]2[cH:15][cH:14][c:13]([O:12][CH3:11])[cH:18][cH:17]2)[c:3]([CH2:8][C:9]#[N:10])[cH:4][cH:5][cH:6][cH:7]1

Participants

11

Reactant 10

HCID 175Acetate3×HCID 259Bromide ionHCID 312ChlorideHCID 813Potassium CationHCID 923Sodium ionHCID 962WaterHCID 16028TetrabutylammoniumHCID 296252-Bromobenzyl cyanideHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 201262(4-Methoxyphenyl)boronic acid

Product 1

HCID 23508412HCID 23508412, compound

Sources & evidence

ORD record
ord-d8d0a15525934512a5415e14fb2bed64
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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