Ethanol → 3-Chloro-6-(3-fluoro-4-methoxyphenyl)pyridazine
Reaction equation
[C:21](=[O:22])([O-:23])[O-:24].[CH3:27][CH2:28][OH:29].[CH3:30][c:31]1[cH:32][cH:33][cH:34][cH:35][cH:36]1.[CH3:37][CH2:38][O:39][C:40]([CH3:41])=[O:42].[Cl:13][c:14]1[n:15][n:16][c:17]([Cl:20])[cH:18][cH:19]1.[F:1][c:2]1[cH:3][c:4]([B:10]([OH:11])[OH:12])[cH:5][cH:6][c:7]1[O:8][CH3:9].[Na+:25].[Na+:26].[OH2:43].[cH:44]1[cH:45][cH:46][c:47]([P:48]([Pd:49]([P:50]([c:51]2[cH:52][cH:53][cH:54][cH:55][cH:56]2)([c:57]2[cH:58][cH:59][cH:60][cH:61][cH:62]2)[c:63]2[cH:64][cH:65][cH:66][cH:67][cH:68]2)([P:69]([c:70]2[cH:71][cH:72][cH:73][cH:74][cH:75]2)([c:76]2[cH:77][cH:78][cH:79][cH:80][cH:81]2)[c:82]2[cH:83][cH:84][cH:85][cH:86][cH:87]2)[P:88]([c:89]2[cH:90][cH:91][cH:92][cH:93][cH:94]2)([c:95]2[cH:96][cH:97][cH:98][cH:99][cH:100]2)[c:101]2[cH:102][cH:103][cH:104][cH:105][cH:106]2)([c:107]2[cH:108][cH:109][cH:110][cH:111][cH:112]2)[c:113]2[cH:114][cH:115][cH:116][cH:117][cH:118]2)[cH:119][cH:120]1>>[F:1][c:2]1[cH:3][c:4](-[c:17]2[n:16][n:15][c:14]([Cl:13])[cH:19][cH:18]2)[cH:5][cH:6][c:7]1[O:8][CH3:9]Participants
10
Reactant 9
Product 1
Sources & evidence
- ORD record
- ord-767ab522813c409d91e451ace399cace
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (10/10)
Reaction notes
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