Acetate → HCID 70498313, compound

HRID 1120180Notes

Reaction equation

HRID 1120180 reaction equation
[CH3:33][C:34]([CH3:35])([O-:36])[CH3:37].[Cl:1][c:2]1[cH:3][cH:4][n:5][c:6]2[c:11]1[CH2:10][N:9]([CH2:12][c:13]1[cH:14][cH:15][c:16]([O:19][CH3:20])[cH:17][cH:18]1)[C:8](=[O:21])[NH:7]2.[Cl:22][c:23]1[c:24]([NH2:32])[c:25]2[c:26]([cH:30][cH:31]1)[O:27][CH2:28][O:29]2.[Na+:38].[O-:46][C:47]([CH3:48])=[O:49].[O-:50][C:51]([CH3:52])=[O:53].[O:39]1[CH2:40][CH2:41][O:42][CH2:43][CH2:44]1.[Pd+2:45]>>[c:2]1([NH:32][c:24]2[c:23]([Cl:22])[cH:31][cH:30][c:26]3[c:25]2[O:29][CH2:28][O:27]3)[cH:3][cH:4][n:5][c:6]2[c:11]1[CH2:10][N:9]([CH2:12][c:13]1[cH:14][cH:15][c:16]([O:19][CH3:20])[cH:17][cH:18]1)[C:8](=[O:21])[NH:7]2

Participants

8

Reactant 7

HCID 175Acetate2×HCID 923Sodium ionHCID 312751,4-DioxaneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 45749132-Methylpropan-2-olateHCID 113672535-Chloro-1,3-benzodioxol-4-amineHCID 669262915-chloro-3-[(4-methoxyphenyl)methyl]-1H,2H,3H,4H-pyrido[2,3-d]pyrimidin-2-one

Product 1

HCID 70498313HCID 70498313, compound

Sources & evidence

ORD record
ord-e52a5744a6244c9fac7829374ed09efd
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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