Water → Ethyl 5-[2,5-difluoro-4-(6-methoxy-2,4-dimethyl-3-pyridinyl)phenyl]-1-(oxolan-3-yl)pyrazole-4-carboxylate

HRID 304795Notes

Reaction equation

HRID 304795 reaction equation
[Br:33][c:34]1[c:35]([CH3:43])[n:36][c:37]([O:41][CH3:42])[cH:38][c:39]1[CH3:40].[CH3:46][O:47][CH2:48][CH2:49][O:50][CH3:51].[F:1][c:2]1[c:3](-[c:18]2[c:19]([C:28](=[O:29])[O:30][CH2:31][CH3:32])[cH:20][n:21][n:22]2[CH:23]2[CH2:24][O:25][CH2:26][CH2:27]2)[cH:4][c:5]([F:17])[c:6]([B:8]2[O:9][C:10]([CH3:11])([CH3:12])[C:13]([CH3:14])([CH3:15])[O:16]2)[cH:7]1.[FH:44].[K:45].[OH2:52].[cH:53]1[cH:54][cH:55][c:56]([P:57]([Pd:58]([P:59]([c:60]2[cH:61][cH:62][cH:63][cH:64][cH:65]2)([c:66]2[cH:67][cH:68][cH:69][cH:70][cH:71]2)[c:72]2[cH:73][cH:74][cH:75][cH:76][cH:77]2)([P:78]([c:79]2[cH:80][cH:81][cH:82][cH:83][cH:84]2)([c:85]2[cH:86][cH:87][cH:88][cH:89][cH:90]2)[c:91]2[cH:92][cH:93][cH:94][cH:95][cH:96]2)[P:97]([c:98]2[cH:99][cH:100][cH:101][cH:102][cH:103]2)([c:104]2[cH:105][cH:106][cH:107][cH:108][cH:109]2)[c:110]2[cH:111][cH:112][cH:113][cH:114][cH:115]2)([c:116]2[cH:117][cH:118][cH:119][cH:120][cH:121]2)[c:122]2[cH:123][cH:124][cH:125][cH:126][cH:127]2)[cH:128][cH:129]1>>[F:1][c:2]1[c:3](-[c:18]2[c:19]([C:28](=[O:29])[O:30][CH2:31][CH3:32])[cH:20][n:21][n:22]2[CH:23]2[CH2:24][O:25][CH2:26][CH2:27]2)[cH:4][c:5]([F:17])[c:6](-[c:34]2[c:35]([CH3:43])[n:36][c:37]([O:41][CH3:42])[cH:38][c:39]2[CH3:40])[cH:7]1

Participants

8

Reactant 7

HCID 962WaterHCID 80711,2-DimethoxyethaneHCID 14917Hydrofluoric AcidHCID 5462222PotassiumHCID 112413813-Bromo-6-methoxy-2,4-dimethylpyridineHCID 89599114Ethyl 5-[2,5-difluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]-1-(oxolan-3-yl)pyrazole-4-carboxylateHCID 178420554HCID 178420554, compound

Product 1

HCID 89599305Ethyl 5-[2,5-difluoro-4-(6-methoxy-2,4-dimethyl-3-pyridinyl)phenyl]-1-(oxolan-3-yl)pyrazole-4-carboxylate

Sources & evidence

ORD record
ord-2af4dcc968e2416cb4913c3a3feae727
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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