Chloride → HCID 57929983, compound

HRID 2332689Notes

Reaction equation

HRID 2332689 reaction equation
[CH2:37]1[O:38][CH2:39][CH2:40][CH2:41]1.[Cl-:42].[Cl-:44].[F:1][c:2]1[c:3](-[c:9]2[n:10][c:11]3[n:12]([c:17]2[I:18])[CH2:13][CH2:14][CH2:15][CH2:16]3)[cH:4][cH:5][c:6]([F:8])[cH:7]1.[I:19][c:20]1[cH:21][cH:22][c:23]2[n:24]([n:25]1)[c:26]([CH:29]([CH3:30])[CH3:31])[n:27][n:28]2.[O:32]=[CH:33][N:34]([CH3:35])[CH3:36].[Zn+2:43].[cH:45]1[cH:46][cH:47][c:48]([P:49]([Pd:50]([P:51]([c:52]2[cH:53][cH:54][cH:55][cH:56][cH:57]2)([c:58]2[cH:59][cH:60][cH:61][cH:62][cH:63]2)[c:64]2[cH:65][cH:66][cH:67][cH:68][cH:69]2)([P:70]([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)[P:89]([c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)[c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)([c:108]2[cH:109][cH:110][cH:111][cH:112][cH:113]2)[c:114]2[cH:115][cH:116][cH:117][cH:118][cH:119]2)[cH:120][cH:121]1>>[F:1][c:2]1[c:3](-[c:9]2[n:10][c:11]3[n:12]([c:17]2-[c:20]2[cH:21][cH:22][c:23]4[n:24]([n:25]2)[c:26]([CH:29]([CH3:30])[CH3:31])[n:27][n:28]4)[CH2:13][CH2:14][CH2:15][CH2:16]3)[cH:4][cH:5][c:6]([F:8])[cH:7]1

Participants

8

Reactant 7

HCID 312Chloride2×HCID 6228DimethylformamideHCID 8028TetrahydrofuranHCID 32051Zinc(2+)HCID 57929883HCID 57929883, compoundHCID 579298936-Iodo-3-isopropyl-[1,2,4]triazolo[4,3-b]pyridazineHCID 178420554HCID 178420554, compound

Product 1

HCID 57929983HCID 57929983, compound

Sources & evidence

ORD record
ord-6ed2d7be663b49f6a533ed5727019f68
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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