3-Chloro-6-(trifluoromethyl)pyridazine → Hydrochloric Acid

HRID 2160002Notes

Reaction equation

HRID 2160002 reaction equation
[CH:1]1([N:5]2[CH2:6][CH2:7][N:8]([C:12](=[O:13])[c:14]3[cH:15][cH:16][c:17]([B:20]4[O:21][C:22]([CH3:23])([CH3:24])[C:25]([CH3:26])([CH3:27])[O:28]4)[cH:18][cH:19]3)[CH2:9][CH2:10][CH2:11]2)[CH2:2][CH2:3][CH2:4]1.[Cl:29][c:30]1[n:31][n:32][c:33]([C:36]([F:37])([F:38])[F:39])[cH:34][cH:35]1>>[CH:1]1([N:5]2[CH2:6][CH2:7][N:8]([C:12](=[O:13])[c:14]3[cH:15][cH:16][c:17](-[c:30]4[n:31][n:32][c:33]([C:36]([F:37])([F:38])[F:39])[cH:34][cH:35]4)[cH:18][cH:19]3)[CH2:9][CH2:10][CH2:11]2)[CH2:2][CH2:3][CH2:4]1.[ClH:29]

Participants

4

Reactant 2

HCID 282425263-Chloro-6-(trifluoromethyl)pyridazineHCID 66930417(4-Cyclobutylhexahydro-1H-1,4-diazepin-1-yl)[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]methanone

Product 2

HCID 313Hydrochloric AcidHCID 11315668(4-Cyclobutyl-1,4-diazepan-1-yl)-[4-[6-(trifluoromethyl)pyridazin-3-yl]phenyl]methanone

Sources & evidence

ORD record
ord-b89ac3549740408b88e07e73fe3b92fb
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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