Methanol → Trifluoroacetic acid

HRID 2347485Notes

Reaction equation

HRID 2347485 reaction equation
[CH3:34][OH:35].[CH:8]1([CH:13]([CH2:14][CH:15]2[CH2:16][CH2:17]2)[n:18]2[n:19][cH:20][c:21](-[c:23]3[c:24]4[c:25]([n:26][cH:27][n:28]3)[nH:29][cH:30][cH:31]4)[cH:22]2)[CH2:9][CH2:10][CH2:11][CH2:12]1.[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7].[H:32][H:33]>>[CH:8]1([CH:13]([CH2:14][CH2:15][CH3:16])[n:18]2[n:19][cH:20][c:21](-[c:23]3[c:24]4[c:25]([n:26][cH:27][n:28]3)[nH:29][cH:30][cH:31]4)[cH:22]2)[CH2:9][CH2:10][CH2:11][CH2:12]1.[F:1][C:2]([C:3](=[O:4])[OH:5])([F:6])[F:7]

Participants

6

Reactant 4

HCID 887MethanolHCID 6422Trifluoroacetic acidHCID 446261724-[1-(1-Cyclopentyl-2-cyclopropylethyl)-1h-pyrazol-4-yl]-7h-pyrrolo[2,3-d]pyrimidineHCID 178418361HCID 178418361, compound

Product 2

HCID 6422Trifluoroacetic acidHCID 446255944-[1-(1-Cyclopentylbutyl)-1h-pyrazol-4-yl]-7h-pyrrolo[2,3-d]pyrimidine

Sources & evidence

ORD record
ord-befd76b48b544d55b0d085ebbcdceb60
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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