Acetic Acid → HCID 16048759, compound

HRID 2139256Notes

Reaction equation

HRID 2139256 reaction equation
[C:29]([O:30][BH-:31]([O:32][C:33](=[O:34])[CH3:35])[O:36][C:37](=[O:38])[CH3:39])(=[O:40])[CH3:41].[CH3:20][CH:21]([CH:22]=[O:23])[CH3:24].[CH3:25][C:26](=[O:27])[OH:28].[CH3:46][OH:47].[Cl:43][CH2:44][Cl:45].[Na+:42].[n:1]1[n:2](-[c:11]2[cH:12][cH:13][c:14]([C:15](=[O:16])[NH2:17])[cH:18][cH:19]2)[cH:3][c:4]2[c:5]1[CH2:6][CH2:7][NH:8][CH2:9][CH2:10]2>>[n:1]1[n:2](-[c:11]2[cH:12][cH:13][c:14]([C:15](=[O:16])[NH2:17])[cH:18][cH:19]2)[cH:3][c:4]2[c:5]1[CH2:6][CH2:7][N:8]([CH2:22][CH:21]([CH3:20])[CH3:24])[CH2:9][CH2:10]2

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 887MethanolHCID 923Sodium ionHCID 6344DichloromethaneHCID 6561IsobutyraldehydeHCID 2724942TriacetoxyborohydrideHCID 66930841HCID 66930841, compound

Product 1

HCID 16048759HCID 16048759, compound

Sources & evidence

ORD record
ord-29edb1a49b64449aa4fa1d59679c9fe3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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