Acetate → HCID 54752886, compound

HRID 172375Notes

Reaction equation

HRID 172375 reaction equation
[C:57]([O-:58])(=[O:59])[CH3:60].[C:62]([O-:63])(=[O:64])[CH3:65].[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]2[cH:8][cH:9][c:10]([Br:15])[cH:11][c:12]2[cH:13][cH:14]1.[CH3:49][c:50]1[cH:51][cH:52][cH:53][cH:54][cH:55]1.[CH:16]1([B:19]([OH:20])[OH:21])[CH2:17][CH2:18]1.[CH:22]1([P:23]([CH:24]2[CH2:25][CH2:26][CH2:27][CH2:28][CH2:29]2)[CH:30]2[CH2:31][CH2:32][CH2:33][CH2:34][CH2:35]2)[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]1.[K+:46].[K+:47].[K+:48].[OH2:56].[P:41]([O-:42])([O-:43])([O-:44])=[O:45].[Pd+2:61]>>[CH3:1][O:2][C:3](=[O:4])[c:5]1[cH:6][c:7]2[cH:8][cH:9][c:10]([CH:16]3[CH2:17][CH2:18]3)[cH:11][c:12]2[cH:13][cH:14]1

Participants

10

Reactant 9

HCID 175Acetate2×HCID 813Potassium Cation3×HCID 962WaterHCID 1061PhosphateHCID 1140TolueneHCID 75806TricyclohexylphosphineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 8541342-Bromo-6-methoxycarbonylnaphthaleneHCID 2760897Cyclopropylboronic acid

Product 1

HCID 54752886HCID 54752886, compound

Sources & evidence

ORD record
ord-021db477a56c4a6f9631f115cecca9f1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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