Dichloromethane → 2,3,5,6-tetrafluoro-4-(methoxymethyl)benzyl (RS)-2-[2-(1,1-dimethylethyl)pyrimidin-5-yl]-3,3-dimethylbutanoate

HRID 136804Notes

Reaction equation

HRID 136804 reaction equation
[CH3:1][C:2]([CH3:3])([CH3:4])[c:5]1[n:6][cH:7][c:8]([CH:11]([C:12](=[O:13])[OH:14])[C:15]([CH3:16])([CH3:17])[CH3:18])[cH:9][n:10]1.[CH3:49][N:50]([CH3:51])[c:52]1[cH:53][cH:54][n:55][cH:56][cH:57]1.[CH:34]1([N:35]=[C:36]=[N:37][CH:38]2[CH2:39][CH2:40][CH2:41][CH2:42][CH2:43]2)[CH2:44][CH2:45][CH2:46][CH2:47][CH2:48]1.[Cl:58][CH2:59][Cl:60].[F:19][c:20]1[c:21]([CH2:22][OH:23])[c:24]([F:33])[c:25]([F:32])[c:26]([CH2:29][O:30][CH3:31])[c:27]1[F:28]>>[CH3:1][C:2]([CH3:3])([CH3:4])[c:5]1[n:6][cH:7][c:8]([CH:11]([C:12](=[O:13])[O:14][CH2:22][c:21]2[c:20]([F:19])[c:27]([F:28])[c:26]([CH2:29][O:30][CH3:31])[c:25]([F:32])[c:24]2[F:33])[C:15]([CH3:16])([CH3:17])[CH3:18])[cH:9][n:10]1

Participants

6

Reactant 5

HCID 6344DichloromethaneHCID 10868DicyclohexylcarbodiimideHCID 142844-(Dimethylamino)pyridineHCID 111721164-Methoxymethyl-2,3,5,6-tetrafluorobenzyl alcoholHCID 147187042-(2-Tert-butylpyrimidin-5-yl)-3,3-dimethylbutanoic acid

Product 1

HCID 147187502,3,5,6-tetrafluoro-4-(methoxymethyl)benzyl (RS)-2-[2-(1,1-dimethylethyl)pyrimidin-5-yl]-3,3-dimethylbutanoate

Sources & evidence

ORD record
ord-59fa9dc84a2d49edbaddcb5189c102d9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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