Dichloromethane → Trifluoroacetic acid

HRID 211407Notes

Reaction equation

HRID 211407 reaction equation
[C:1]([O:2][C:3](=[O:4])[N:8]1[CH2:9][CH2:10][CH:11]([n:14]2[n:15][cH:16][c:17]3[c:18]2[n:19][cH:20][n:21][c:22]3[O:23][c:24]2[c:25]([F:33])[cH:26][c:27]([O:30][CH2:31][CH3:32])[cH:28][cH:29]2)[CH2:12][CH2:13]1)([CH3:5])([CH3:6])[CH3:7].[Cl:34][CH2:35][Cl:36].[F:37][C:38]([C:39](=[O:40])[OH:41])([F:42])[F:43]>>[F:37][C:38]([C:39](=[O:40])[OH:41])([F:42])[F:43].[NH:8]1[CH2:9][CH2:10][CH:11]([n:14]2[n:15][cH:16][c:17]3[c:18]2[n:19][cH:20][n:21][c:22]3[O:23][c:24]2[c:25]([F:33])[cH:26][c:27]([O:30][CH2:31][CH3:32])[cH:28][cH:29]2)[CH2:12][CH2:13]1

Participants

5

Reactant 3

HCID 6344DichloromethaneHCID 6422Trifluoroacetic acidHCID 445141064-[4-(4-Ethoxy-2-fluoro-phenoxy)-pyrazolo[3,4-d]pyrimidin-1-yl]-piperidine-1-carboxylic acid tert-butyl ester

Product 2

HCID 6422Trifluoroacetic acidHCID 579648844-(4-Ethoxy-2-fluorophenoxy)-1-piperidin-4-ylpyrazolo[5,4-d]pyrimidine

Sources & evidence

ORD record
ord-db9cd673e5264cf998f1a93f7c9f3cad
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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