Methanol → 4-Benzyl-6-bromo-2,3,4,5-tetrahydro-1,4-benzoxazepine

HRID 1118761Notes

Reaction equation

HRID 1118761 reaction equation
[BH3:26].[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][O:11][c:12]2[c:13]([c:16]([Br:20])[cH:17][cH:18][cH:19]2)[C:14]1=[O:15].[CH3:27][OH:28].[Na+:30].[O:21]1[CH2:22][CH2:23][CH2:24][CH2:25]1.[O:31]1[CH2:32][CH2:33][CH2:34][CH2:35]1.[OH-:29]>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[N:8]1[CH2:9][CH2:10][O:11][c:12]2[c:13]([c:16]([Br:20])[cH:17][cH:18][cH:19]2)[CH2:14]1

Participants

7

Reactant 6

HCID 887MethanolHCID 923Sodium ionHCID 961HydroxideHCID 6331BoraneHCID 8028Tetrahydrofuran2×HCID 685778484-benzyl-6-bromo-3,4-dihydro-1,4-benzoxazepine-5 (2H)-one

Product 1

HCID 685782294-Benzyl-6-bromo-2,3,4,5-tetrahydro-1,4-benzoxazepine

Sources & evidence

ORD record
ord-957695b484e24bb99e600a50dd38cf61
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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