Methanol → Hydrochloric Acid

HRID 1130005Notes

Reaction equation

HRID 1130005 reaction equation
[CH3:1][OH:2].[CH3:28][c:29]1[cH:30][cH:31][cH:32][cH:33][cH:34]1.[CH3:3][C:4]([Cl:5])=[O:6].[Cl:7][c:8]1[c:9]([N:14]2[CH2:15][CH2:16][N:17]([CH2:20][c:21]3[cH:22][n:23][n:24]([CH3:27])[c:25]3[CH3:26])[CH2:18][CH2:19]2)[n:10][cH:11][cH:12][n:13]1>>[Cl:7][c:8]1[c:9]([N:14]2[CH2:15][CH2:16][N:17]([CH2:20][c:21]3[cH:22][n:23][n:24]([CH3:27])[c:25]3[CH3:26])[CH2:18][CH2:19]2)[n:10][cH:11][cH:12][n:13]1.[ClH:5]

Participants

6

Reactant 4

HCID 887MethanolHCID 1140TolueneHCID 6367Acetyl chlorideHCID 594382163'-chloro-4-(1,5-dimethyl-1H-pyrazol-4-ylmethyl)-3,4,5,6-tetrahydro-2H-[1,2']bipyrazinyl

Product 2

HCID 313Hydrochloric AcidHCID 594382163'-chloro-4-(1,5-dimethyl-1H-pyrazol-4-ylmethyl)-3,4,5,6-tetrahydro-2H-[1,2']bipyrazinyl

Sources & evidence

ORD record
ord-91ce6096ed3349a0af278068ed215686
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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