Acetonitrile → Bupropion

HRID 1114953Notes

Reaction equation

HRID 1114953 reaction equation
[Br:1][CH:2]([C:3](=[O:4])[c:5]1[cH:6][c:7]([Cl:11])[cH:8][cH:9][cH:10]1)[CH3:12].[CH3:13][C:14]([CH3:15])([CH3:16])[NH2:17].[CH3:18][CH2:19][CH2:20][CH2:21][CH2:22][CH3:23].[CH3:24][CH2:25][O:26][C:27](=[O:28])[CH3:29].[CH3:30][C:31]#[N:32]>>[CH:2]([C:3](=[O:4])[c:5]1[cH:6][c:7]([Cl:11])[cH:8][cH:9][cH:10]1)([CH3:12])[NH:17][C:14]([CH3:13])([CH3:15])[CH3:16]

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 6385Tert-ButylamineHCID 8058HexaneHCID 8857Ethyl AcetateHCID 4992116alpha-Bromo-3-chloropropiophenone

Product 1

HCID 444Bupropion

Sources & evidence

ORD record
ord-6a6329cbc71d4d0f9f367fe45bd9f24c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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