Acetic Acid → HCID 66881004, compound

HRID 118663Notes

Reaction equation

HRID 118663 reaction equation
[C:21]([BH3-:22])#[N:23].[CH2:1]=[N:2][N:3]1[CH2:4][CH2:5][N:6]([S:9](=[O:10])(=[O:11])[c:12]2[c:13]([N+:18](=[O:19])[O-:20])[cH:14][cH:15][cH:16][cH:17]2)[CH2:7][CH2:8]1.[CH3:27][OH:28].[CH3:29][C:30](=[O:31])[OH:32].[Na+:24].[Na+:26].[OH-:25]>>[CH3:1][NH:2][N:3]1[CH2:4][CH2:5][N:6]([S:9](=[O:10])(=[O:11])[c:12]2[c:13]([N+:18](=[O:19])[O-:20])[cH:14][cH:15][cH:16][cH:17]2)[CH2:7][CH2:8]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ion2×HCID 961HydroxideHCID 498716Cyano-borohydrideHCID 66881481HCID 66881481, compound

Product 1

HCID 66881004HCID 66881004, compound

Sources & evidence

ORD record
ord-5aa7616531b44928be0e3fc405e714c0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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