Formaldehyde → 6,7-Dichloro-3,5-dimethyl-1,2,4,5-tetrahydro-3-benzazepine

HRID 1153004Notes

Reaction equation

HRID 1153004 reaction equation
[C:15]([O:16][BH-:17]([O:18][C:19](=[O:20])[CH3:21])[O:22][C:23](=[O:24])[CH3:25])(=[O:26])[CH3:27].[CH2:29]=[O:30].[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([c:13]1[Cl:14])[CH:7]([CH3:12])[CH2:8][NH:9][CH2:10][CH2:11]2.[Cl:31][CH:32]([Cl:33])[CH3:34].[Na+:28].[Na+:36].[OH-:35]>>[Cl:1][c:2]1[cH:3][cH:4][c:5]2[c:6]([c:13]1[Cl:14])[CH:7]([CH3:12])[CH2:8][N:9]([CH3:15])[CH2:10][CH2:11]2

Participants

7

Reactant 6

HCID 712FormaldehydeHCID 923Sodium ion2×HCID 961HydroxideHCID 63651,1-DichloroethaneHCID 2724942TriacetoxyborohydrideHCID 114475526,7-dichloro-5-methyl-2,3,4,5-tetrahydro-1H-3-benzazepine

Product 1

HCID 114479126,7-Dichloro-3,5-dimethyl-1,2,4,5-tetrahydro-3-benzazepine

Sources & evidence

ORD record
ord-434a0ecbf5a04b74ad7cec1966f0f72e
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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