Ethanol → HCID 58012397, compound

HRID 135396Notes

Reaction equation

HRID 135396 reaction equation
[BH4-:34].[CH3:30][OH:31].[CH3:32][NH2:33].[CH3:37][CH2:38][OH:39].[Cl:1][c:2]1[cH:3][c:4]([O:28][CH3:29])[c:5]([NH:9][c:10]2[n:11][c:12]3[c:13]([n:14]2[CH3:15])[c:16](-[c:20]2[c:21]([CH:22]=[O:23])[cH:24][cH:25][cH:26][cH:27]2)[cH:17][cH:18][cH:19]3)[c:6]([CH3:8])[cH:7]1.[Na+:35].[OH2:36]>>[Cl:1][c:2]1[cH:3][c:4]([O:28][CH3:29])[c:5]([NH:9][c:10]2[n:11][c:12]3[c:13]([n:14]2[CH3:15])[c:16](-[c:20]2[c:21]([CH2:22][NH:33][CH3:32])[cH:24][cH:25][cH:26][cH:27]2)[cH:17][cH:18][cH:19]3)[c:6]([CH3:8])[cH:7]1

Participants

8

Reactant 7

HCID 702EthanolHCID 887MethanolHCID 923Sodium ionHCID 962WaterHCID 6329MethylamineHCID 28123BorohydrideHCID 58012434HCID 58012434, compound

Product 1

HCID 58012397HCID 58012397, compound

Sources & evidence

ORD record
ord-5a7cc50363674fdc8e9281ff2079c91c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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