Acetic Acid → HCID 178483329, compound

HRID 196358Notes

Reaction equation

HRID 196358 reaction equation
[C:17]([BH3-:18])#[N:19].[CH2:21]=[O:22].[CH3:25][OH:26].[CH3:30][CH2:31][O:32][C:33](=[O:34])[CH3:35].[CH3:36][C:37](=[O:38])[OH:39].[Cl-:29].[Na+:20].[Na+:24].[Na+:28].[OH-:23].[OH2:27].[nH:1]1[n:2][c:3]([CH2:14][NH:15][CH3:16])[c:4]2[c:9]1-[c:8]1[c:7]([cH:13][cH:12][cH:11][cH:10]1)[CH2:6][CH2:5]2>>[nH:1]1[n:2][c:3]([CH2:14][N:15]([CH3:16])[CH3:17])[c:4]2[c:9]1-[c:8]1[c:7]([cH:13][cH:12][cH:11][cH:10]1)[CH2:6][CH2:5]2

Participants

11

Reactant 10

HCID 176Acetic AcidHCID 312ChlorideHCID 712FormaldehydeHCID 887MethanolHCID 923Sodium ion3×HCID 961HydroxideHCID 962WaterHCID 8857Ethyl AcetateHCID 498716Cyano-borohydrideHCID 178483113HCID 178483113, compound

Product 1

HCID 178483329HCID 178483329, compound

Sources & evidence

ORD record
ord-fdad3a6733644444b402046aa01fa996
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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