Acetic Acid → HCID 57626337, compound

HRID 1546043Notes

Reaction equation

HRID 1546043 reaction equation
[BH4-:37].[CH3:16][O-:17].[CH3:23][C:24]([O:25][C:26](=[O:27])[CH3:28])=[O:29].[CH3:30][CH2:31][N:32]([CH2:33][CH3:34])[CH2:35][CH3:36].[CH3:39][CH2:40][O:41][C:42](=[O:43])[CH3:44].[CH3:46][C:47](=[O:48])[OH:49].[CH3:50][S:51](=[O:52])[CH3:53].[CH3:54][OH:55].[Li+:18].[N+:19](=[O:20])([O-:21])[CH3:22].[Na+:38].[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][cH:10][c:11]([CH:14]=[O:15])[n:12][cH:13]1.[OH2:45]>>[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][cH:10][c:11]([CH2:14][CH2:22][N+:19](=[O:20])[O-:21])[n:12][cH:13]1

Participants

14

Reactant 13

HCID 176Acetic AcidHCID 679Dimethyl SulfoxideHCID 887MethanolHCID 923Sodium ionHCID 962WaterHCID 6375NitromethaneHCID 7918Acetic AnhydrideHCID 8471TriethylamineHCID 8857Ethyl AcetateHCID 28123BorohydrideHCID 28486Lithium ionHCID 3826051MethoxideHCID 544159545-Phenoxypicolinaldehyde

Product 1

HCID 57626337HCID 57626337, compound

Sources & evidence

ORD record
ord-b2059489c69a41f4b41b774d653ed785
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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