Ethanol → HCID 86751684, compound

HRID 139226Notes

Reaction equation

HRID 139226 reaction equation
[BH4-:36].[CH3:38][CH2:39][OH:40].[CH:1]([CH3:2])([CH3:3])[N:4]([CH2:5][C:6]#[C:7][CH2:8][NH:9][C:10](=[O:11])[C:12]12[CH2:13][CH:14]3[CH2:15][CH:16]([CH2:17][CH:18]([CH2:19]1)[CH2:20]3)[CH2:21]2)[CH2:22][CH2:23][c:24]1[c:25]([O:30][CH3:31])[cH:26][cH:27][cH:28][cH:29]1.[NH2:32][CH2:33][CH2:34][NH2:35].[Na+:37].[Ni:47]([Cl:48])[Cl:49].[OH2:41].[OH2:42].[OH2:43].[OH2:44].[OH2:45].[OH2:46]>>[CH:1]([CH3:2])([CH3:3])[N:4]([CH2:5][CH:6]=[CH:7][CH2:8][NH:9][C:10](=[O:11])[C:12]12[CH2:13][CH:14]3[CH2:15][CH:16]([CH2:17][CH:18]([CH2:19]1)[CH2:20]3)[CH2:21]2)[CH2:22][CH2:23][c:24]1[c:25]([O:30][CH3:31])[cH:26][cH:27][cH:28][cH:29]1

Participants

8

Reactant 7

HCID 702EthanolHCID 923Sodium ionHCID 962Water6×HCID 3301EthylenediamineHCID 24385Nickel DichlorideHCID 28123BorohydrideHCID 86751685HCID 86751685, compound

Product 1

HCID 86751684HCID 86751684, compound

Sources & evidence

ORD record
ord-97c81143b9a04aa09dc40e18f57085d1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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