Hydrochloric Acid → Hydrochloric Acid

HRID 110758

Reaction equation

HRID 110758 reaction equation
[CH3:17][C:18]([CH3:19])([O-:20])[CH3:21].[CH3:1][c:2]1[cH:3][c:4]([CH2:8][CH2:9][c:10]2[c:11]([OH:16])[cH:12][cH:13][cH:14][cH:15]2)[cH:5][cH:6][cH:7]1.[CH3:33][C:34]([N:35]([CH3:36])[CH3:37])=[O:38].[Cl:24][CH2:25][CH2:26][CH:27]1[N:28]([CH3:32])[CH2:29][CH2:30][CH2:31]1.[ClH:23].[K+:22]>>[CH3:1][c:2]1[cH:3][c:4]([CH2:8][CH2:9][c:10]2[c:11]([O:16][CH2:25][CH2:26][CH:27]3[N:28]([CH3:32])[CH2:29][CH2:30][CH2:31]3)[cH:12][cH:13][cH:14][cH:15]2)[cH:5][cH:6][cH:7]1.[ClH:24]

Participants

8

Reactant 6

HCID 313Hydrochloric AcidHCID 813Potassium CationHCID 31374DimethylacetamideHCID 2850932-(2-Chloroethyl)-1-methylpyrrolidineHCID 45749132-Methylpropan-2-olateHCID 106323412-[2-(3-Methylphenyl)ethyl]phenol

Product 2

HCID 313Hydrochloric AcidHCID 107847231-Methyl-2-(2-{2-[2-(3-methylphenyl)ethyl]phenoxy}ethyl)pyrrolidine

Sources & evidence

ORD record
ord-6de96a473de5497480262f8012a358b8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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