Acetic Acid → HCID 70052738, compound

HRID 194188Notes

Reaction equation

HRID 194188 reaction equation
[CH3:12][C:13]1([c:18]2[cH:19][cH:20][c:21]3[c:22]([cH:49]2)[C:23]([c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)=[N:24][CH2:25][C:26]([O:28][P:29]([N:30]2[CH2:31][CH2:32][O:33][CH2:34][CH2:35]2)([N:36]2[CH2:37][CH2:38][O:39][CH2:40][CH2:41]2)=[O:42])=[N:27]3)[O:14][CH2:15][CH2:16][O:17]1.[CH3:1][N:2]([CH3:3])[CH:4]=[O:5].[CH3:50][C:51](=[O:52])[OH:53].[H-:10].[N+:6](=[O:7])([O-:8])[CH3:9].[Na+:11]>>[N+:6](=[O:7])([O-:8])[CH:9]=[C:26]1[CH2:25][N:24]=[C:23]([c:43]2[cH:44][cH:45][cH:46][cH:47][cH:48]2)[c:22]2[c:21]([cH:20][cH:19][c:18]([C:13]3([CH3:12])[O:14][CH2:15][CH2:16][O:17]3)[cH:49]2)[NH:27]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 923Sodium ionHCID 6228DimethylformamideHCID 6375NitromethaneHCID 166653HydrideHCID 20464478HCID 20464478, compound

Product 1

HCID 70052738HCID 70052738, compound

Sources & evidence

ORD record
ord-24362992aa44493fa4615edcae0910ae
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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