5-Bromo-2-(3,4-dimethoxyphenyl)-2-isopropylpentanenitrile → HCID 25130666, compound
Reaction equation
Br[CH2:2][CH2:3][CH2:4][C:5]([C:11]1[CH:16]=[CH:15][C:14]([O:17][CH3:18])=[C:13]([O:19][CH3:20])[CH:12]=1)([CH:8]([CH3:10])[CH3:9])[C:6]#[N:7].[CH3:21][NH:22][CH2:23][CH2:24][C:25]1[CH:26]=[C:27]([C:35]([O:37][CH3:38])=[O:36])[CH:28]=[C:29]([CH:34]=1)[C:30]([O:32][CH3:33])=[O:31]>>[C:6]([C:5]([C:11]1[CH:16]=[CH:15][C:14]([O:17][CH3:18])=[C:13]([O:19][CH3:20])[CH:12]=1)([CH:8]([CH3:10])[CH3:9])[CH2:4][CH2:3][CH2:2][N:22]([CH3:21])[CH2:23][CH2:24][C:25]1[CH:34]=[C:29]([C:30]([O:32][CH3:33])=[O:31])[CH:28]=[C:27]([CH:26]=1)[C:35]([O:37][CH3:38])=[O:36])#[N:7]Participants
3
Procedure
Reaction of 1f with 2i produced 3ai. MS found M+H=511. The oxalate salt of 3ai was recrystallized from hexane/ethyl acetate; mp 100-103° C.
Workup
- customproduced 3ai
- customThe oxalate salt of 3ai was recrystallized from hexane/ethyl acetate
Sources & evidence
- ORD record
- ord-aff34dc302a6453bb1660079a49e5687
- Source dataset
- uspto-grants-2016_01
- Patent number
- US09227918B2
Reaction notes
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