Acetic Acid → HCID 178426382, compound

HRID 670993Notes

Reaction equation

HRID 670993 reaction equation
[BH4-:23].[C:25]([OH:26])(=[O:27])[CH3:28].[CH3:33][CH2:34][OH:35].[CH:29]([OH:30])([CH3:31])[CH3:32].[Na+:24].[Ni:36]([Cl:37])[Cl:38].[S:1]([CH:2]1[CH:3]([OH:4])[CH:5]([OH:6])[CH:7]([OH:8])[CH:9]([CH2:11][OH:12])[O:10]1)[CH:13]1[C:14]([CH3:21])([CH3:22])[CH2:15][CH:16]([N:18]=[N+:19]=[N-:20])[CH2:17]1>>[S:1]([CH:2]1[CH:3]([OH:4])[CH:5]([OH:6])[CH:7]([OH:8])[CH:9]([CH2:11][OH:12])[O:10]1)[CH:13]1[C:14]([CH3:21])([CH3:22])[CH2:15][CH:16]([NH2:18])[CH2:17]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 702EthanolHCID 923Sodium ionHCID 3776IsopropanolHCID 24385Nickel DichlorideHCID 28123BorohydrideHCID 178426645HCID 178426645, compound

Product 1

HCID 178426382HCID 178426382, compound

Sources & evidence

ORD record
ord-7c977ac777ab46b68e29b4aad547afb5
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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