Methane → Hydrochloric Acid

HRID 153101Notes

Reaction equation

HRID 153101 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([O:14][c:15]2[cH:16][c:17]([CH3:24])[c:18]([N+:21]([O-:22])=[O:23])[cH:19][cH:20]2)[CH2:12][CH2:13]1.[C:29].[CH3:26][CH2:27][OH:28].[ClH:25].[Pd:30]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([O:14][c:15]2[cH:16][c:17]([CH3:24])[c:18]([NH2:21])[cH:19][cH:20]2)[CH2:12][CH2:13]1.[ClH:25]

Participants

7

Reactant 5

HCID 297MethaneHCID 313Hydrochloric AcidHCID 702EthanolHCID 23938PalladiumHCID 18542679Tert-butyl 4-(3-methyl-4-nitrophenoxy)piperidine-1-carboxylate

Product 2

HCID 313Hydrochloric AcidHCID 18542772Tert-butyl 4-(3-methyl-4-aminophenoxy)piperidine-1-carboxylate

Sources & evidence

ORD record
ord-879444e0718646e6bd4361e1c826a574
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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