Acetic Acid → HCID 54164352, compound

HRID 1122705Notes

Reaction equation

HRID 1122705 reaction equation
[CH3:23][NH2:24].[CH3:25][CH2:26][OH:27].[CH3:28][C:29](=[O:30])[OH:31].[CH3:36][OH:37].[N+:32](=[O:33])([O-:34])[CH3:35].[c:1]1([CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][O:12][c:13]2[c:14]([CH:15]=[O:16])[cH:17][cH:18][cH:19][c:20]2[O:21][CH3:22])[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH2:7][CH2:8][CH2:9][CH2:10][CH2:11][O:12][c:13]2[c:14]([CH:15]=[CH:35][N+:32](=[O:33])[O-:34])[cH:17][cH:18][cH:19][c:20]2[O:21][CH3:22])[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 702EthanolHCID 887MethanolHCID 6329MethylamineHCID 6375NitromethaneHCID 21697292HCID 21697292, compound

Product 1

HCID 54164352HCID 54164352, compound

Sources & evidence

ORD record
ord-b1430c528b6446efb6a4cc37e4f043c4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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