Acetic Acid → HCID 20228666, compound

HRID 299739Notes

Reaction equation

HRID 299739 reaction equation
[CH2:22]=[O:23].[CH3:1][c:2]1[cH:3][c:4]2[n:5]([cH:6][cH:7]1)[cH:8][c:9](-[c:11]1[cH:12][cH:13][c:14]3[c:15]([n:16]([CH3:20])[c:17](=[O:19])[s:18]3)[cH:21]1)[n:10]2.[CH3:24][NH:25][CH3:26].[CH3:27][C:28](=[O:29])[OH:30].[CH3:31][CH2:32][O:33][C:34](=[O:35])[CH3:36].[CH3:37][OH:38]>>[CH3:1][c:2]1[cH:3][c:4]2[n:5]([cH:6][cH:7]1)[c:8]([CH2:27][N:25]([CH3:24])[CH3:26])[c:9](-[c:11]1[cH:12][cH:13][c:14]3[c:15]([n:16]([CH3:20])[c:17](=[O:19])[s:18]3)[cH:21]1)[n:10]2

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 674DimethylamineHCID 712FormaldehydeHCID 887MethanolHCID 8857Ethyl AcetateHCID 20228718HCID 20228718, compound

Product 1

HCID 20228666HCID 20228666, compound

Sources & evidence

ORD record
ord-3aaa9bd0b87f4fec985e0f2c3d328662
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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