Acetate → HCID 68431068, compound

HRID 123981Notes

Reaction equation

HRID 123981 reaction equation
[C:42]([P:43]([C:44]([CH3:45])([CH3:46])[CH3:47])[c:48]1[cH:49][cH:50][cH:51][cH:52][c:53]1-[c:54]1[cH:55][cH:56][cH:57][cH:58][cH:59]1)([CH3:60])([CH3:61])[CH3:62].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([Br:24])[c:13]([F:23])[c:14]1[N:15]1[CH2:16][C:17](=[O:22])[NH:18][S:19]1(=[O:20])=[O:21].[CH3:25][C:26]([C:27]#[N:28])([CH2:29][CH2:30][CH2:31][CH:32]=[CH2:33])[CH3:34].[CH3:35][CH2:36][N:37]([CH2:38][CH3:39])[CH2:40][CH3:41].[CH3:63][C:64]#[N:65].[O-:67][C:68]([CH3:69])=[O:70].[O-:71][C:72]([CH3:73])=[O:74].[Pd+2:66]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][c:9]1[cH:10][cH:11][c:12]([CH:33]=[CH:32][CH2:31][CH2:30][CH2:29][C:26]([CH3:25])([C:27]#[N:28])[CH3:34])[c:13]([F:23])[c:14]1[N:15]1[CH2:16][C:17](=[O:22])[NH:18][S:19]1(=[O:20])=[O:21]

Participants

8

Reactant 7

HCID 175Acetate2×HCID 6342AcetonitrileHCID 8471TriethylamineHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 27342152-(Di-tert-butylphosphino)biphenylHCID 68429374HCID 68429374, compoundHCID 85622393HCID 85622393, compound

Product 1

HCID 68431068HCID 68431068, compound

Sources & evidence

ORD record
ord-2b0b5ae9e8bf485c80a77b9877835fd4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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