1,2-Dichloroethane → 2-(5-Bromo-2-fluorophenyl)-2-[(4-methoxyphenyl)methylamino]propan-1-ol

HRID 684630Notes

Reaction equation

HRID 684630 reaction equation
[C:24]([O:25][BH-:26]([O:27][C:28](=[O:29])[CH3:30])[O:31][C:32](=[O:33])[CH3:34])(=[O:35])[CH3:36].[C:38](=[O:39])([O-:40])[OH:41].[CH3:14][O:15][c:16]1[cH:17][cH:18][c:19]([CH:20]=[O:21])[cH:22][cH:23]1.[CH3:47][CH2:48][O:49][C:50](=[O:51])[CH3:52].[CH3:53][CH2:54][CH2:55][CH2:56][CH2:57][CH2:58][CH3:59].[Cl:43][CH2:44][CH2:45][Cl:46].[NH2:1][C:2]([CH2:3][OH:4])([CH3:5])[c:6]1[c:7]([F:13])[cH:8][cH:9][c:10]([Br:12])[cH:11]1.[Na+:37].[Na+:42]>>[NH:1]([C:2]([CH2:3][OH:4])([CH3:5])[c:6]1[c:7]([F:13])[cH:8][cH:9][c:10]([Br:12])[cH:11]1)[CH2:20][c:19]1[cH:18][cH:17][c:16]([O:15][CH3:14])[cH:23][cH:22]1

Participants

9

Reactant 8

HCID 111,2-DichloroethaneHCID 769Bicarbonate IonHCID 923Sodium ion2×HCID 8857Ethyl AcetateHCID 8900HeptaneHCID 312444-MethoxybenzaldehydeHCID 2724942TriacetoxyborohydrideHCID 575142112-Amino-2-(5-bromo-2-fluorophenyl)propan-1-ol

Product 1

HCID 669316342-(5-Bromo-2-fluorophenyl)-2-[(4-methoxyphenyl)methylamino]propan-1-ol

Sources & evidence

ORD record
ord-e97e0b897f1546be971d72833a860855
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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