Acetate → HCID 77568389, compound

HRID 2133009Notes

Reaction equation

HRID 2133009 reaction equation
[C:45](=[O:46])([O-:47])[O-:48].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][C:11]2([CH2:12][NH:13][c:14]3[cH:15][cH:16][cH:17][c:18]([CH:20]4[N:21]([C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[CH2:22][CH2:23][CH2:24]4)[c:19]32)[CH2:32][CH2:33]1.[CH3:51][c:52]1[cH:53][cH:54][cH:55][cH:56][cH:57]1.[Cl:34][c:35]1[c:36]2[c:37]([n:38][cH:39][n:40]1)[CH2:41][CH2:42][CH:43]2[CH3:44].[Cs+:49].[Cs+:50].[O-:59][C:60]([CH3:61])=[O:62].[O-:63][C:64]([CH3:65])=[O:66].[Pd+2:58]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][C:11]2([CH2:12][N:13]([c:35]3[c:36]4[c:37]([n:38][cH:39][n:40]3)[CH2:41][CH2:42][CH:43]4[CH3:44])[c:14]3[cH:15][cH:16][cH:17][c:18]([CH:20]4[N:21]([C:25](=[O:26])[O:27][C:28]([CH3:29])([CH3:30])[CH3:31])[CH2:22][CH2:23][CH2:24]4)[c:19]32)[CH2:32][CH2:33]1

Participants

8

Reactant 7

HCID 175Acetate2×HCID 1140TolueneHCID 19660Carbonate IonHCID 104967Cesium cation2×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 68760889HCID 68760889, compoundHCID 723535034-Chloro-5-methyl-6,7-dihydro-5h-cyclopenta[d]pyrimidine

Product 1

HCID 77568389HCID 77568389, compound

Sources & evidence

ORD record
ord-3fb409ddaa6d4350acc431d108a5608e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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