Methanol → 1-[3,5-Bis(trifluoromethyl)benzoyl]-2-[3-[(2-methoxyethoxy)methoxy]-4-methylbenzyl]piperazine

HRID 2330085Notes

Reaction equation

HRID 2330085 reaction equation
[C+4:47].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH:10]([CH2:30][c:31]2[cH:32][c:33]([O:38][CH2:39][O:40][CH2:41][CH2:42][O:43][CH3:44])[c:34]([CH3:37])[cH:35][cH:36]2)[N:11]([C:14]([c:15]2[cH:16][c:17]([C:25]([F:26])([F:27])[F:28])[cH:18][c:19]([C:21]([F:22])([F:23])[F:24])[cH:20]2)=[O:29])[CH2:12][CH2:13]1.[CH3:45][OH:46].[OH-:48].[OH-:50].[OH-:51].[OH-:52].[OH-:53].[OH-:54].[Pd+2:49]>>[NH:8]1[CH2:9][CH:10]([CH2:30][c:31]2[cH:32][c:33]([O:38][CH2:39][O:40][CH2:41][CH2:42][O:43][CH3:44])[c:34]([CH3:37])[cH:35][cH:36]2)[N:11]([C:14]([c:15]2[cH:16][c:17]([C:25]([F:26])([F:27])[F:28])[cH:18][c:19]([C:21]([F:22])([F:23])[F:24])[cH:20]2)=[O:29])[CH2:12][CH2:13]1

Participants

6

Reactant 5

HCID 887MethanolHCID 961Hydroxide6×HCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 178420935HCID 178420935, compoundHCID 178496289HCID 178496289, compound

Product 1

HCID 179639311-[3,5-Bis(trifluoromethyl)benzoyl]-2-[3-[(2-methoxyethoxy)methoxy]-4-methylbenzyl]piperazine

Sources & evidence

ORD record
ord-9359293a2f77480eb455d76ad2ade4eb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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