Sodium ion → Phenethylamine

HRID 153936Notes

Reaction equation

HRID 153936 reaction equation
[BH3:33].[BH4-:19].[Br:14][C:15]([Br:16])([Br:17])[Br:18].[Br:6][C:7]([Br:8])([Br:9])[C:10]([Br:11])([Br:12])[Br:13].[CH2:1]([Li:2])[CH2:3][CH2:4][CH3:5].[CH3:34][CH2:35][CH2:36][CH2:37][CH2:38][CH3:39].[N:24]#[C:25][CH2:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1.[Na+:20].[Na:21][C:22]#[N:23].[O:40]1[CH2:41][CH2:42][CH2:43][CH2:44]1.[OH2:45]>>[NH2:24][CH2:25][CH2:26][c:27]1[cH:28][cH:29][cH:30][cH:31][cH:32]1

Participants

12

Reactant 11

HCID 923Sodium ionHCID 962WaterHCID 6331BoraneHCID 8028TetrahydrofuranHCID 8058HexaneHCID 8794PhenylacetonitrileHCID 11205Carbon tetrabromideHCID 28123BorohydrideHCID 136384HexabromoethaneHCID 178418339ButyllithiumHCID 178511850HCID 178511850, compound

Product 1

HCID 1001Phenethylamine

Sources & evidence

ORD record
ord-60ee560b3a2d47bca2aaa6485477698c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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