Potassium Cation → HCID 76167663, compound

HRID 302836Notes

Reaction equation

HRID 302836 reaction equation
[Br:1][c:2]1[cH:3][n:4][n:5]([CH3:8])[c:6]1[Cl:7].[C:39](=[O:40])([O-:41])[O-:42].[Cl:45][CH2:46][Cl:47].[Cl:9][c:10]1[c:11]([CH:19]([CH3:20])[c:21]2[cH:22][nH:23][c:24]3[n:25][cH:26][c:27]([B:30]4[O:31][C:32]([CH3:33])([CH3:34])[C:35]([CH3:36])([CH3:37])[O:38]4)[cH:28][c:29]23)[c:12]([O:17][CH3:18])[cH:13][cH:14][c:15]1[F:16].[K+:43].[K+:44].[O:125]1[CH2:126][CH2:127][O:128][CH2:129][CH2:130]1.[cH:48]1[cH:49][cH:50][c:51]([P:52]([Pd:53]([P:54]([c:55]2[cH:56][cH:57][cH:58][cH:59][cH:60]2)([c:61]2[cH:62][cH:63][cH:64][cH:65][cH:66]2)[c:67]2[cH:68][cH:69][cH:70][cH:71][cH:72]2)([P:73]([c:74]2[cH:75][cH:76][cH:77][cH:78][cH:79]2)([c:80]2[cH:81][cH:82][cH:83][cH:84][cH:85]2)[c:86]2[cH:87][cH:88][cH:89][cH:90][cH:91]2)[P:92]([c:93]2[cH:94][cH:95][cH:96][cH:97][cH:98]2)([c:99]2[cH:100][cH:101][cH:102][cH:103][cH:104]2)[c:105]2[cH:106][cH:107][cH:108][cH:109][cH:110]2)([c:111]2[cH:112][cH:113][cH:114][cH:115][cH:116]2)[c:117]2[cH:118][cH:119][cH:120][cH:121][cH:122]2)[cH:123][cH:124]1>>[c:2]1(-[c:27]2[cH:26][n:25][c:24]3[nH:23][cH:22][c:21]([CH:19]([c:11]4[c:10]([Cl:9])[c:15]([F:16])[cH:14][cH:13][c:12]4[O:17][CH3:18])[CH3:20])[c:29]3[cH:28]2)[cH:3][n:4][n:5]([CH3:8])[c:6]1[Cl:7]

Participants

8

Reactant 7

HCID 813Potassium Cation2×HCID 6344DichloromethaneHCID 19660Carbonate IonHCID 312751,4-DioxaneHCID 67004608HCID 67004608, compoundHCID 178420554HCID 178420554, compoundHCID 1784918213-[1-(2-chloro-3-fluoro-6-methoxyphenyl)ethyl]-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine

Product 1

HCID 76167663HCID 76167663, compound

Sources & evidence

ORD record
ord-a71e2912ef284b73bf9c1378b280df9c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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