Acetic Acid → HCID 44816057, compound

HRID 1136554Notes

Reaction equation

HRID 1136554 reaction equation
[C:29]([OH:30])(=[O:31])[CH3:32].[CH2:20]([CH2:21][CH3:22])[NH:23][CH2:24][CH2:25][CH3:26].[CH2:27]=[O:28].[Cl:1][c:2]1[c:3](-[c:9]2[n:10]3[c:11]([o:12][c:13]2[CH2:14][CH3:15])[cH:16][c:17]([CH3:19])[n:18]3)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1>>[Cl:1][c:2]1[c:3](-[c:9]2[n:10]3[c:11]([o:12][c:13]2[CH2:14][CH3:15])[c:16]([CH2:27][N:23]([CH2:20][CH2:21][CH3:22])[CH2:24][CH2:25][CH3:26])[c:17]([CH3:19])[n:18]3)[cH:4][cH:5][c:6]([Cl:8])[cH:7]1

Participants

5

Reactant 4

HCID 176Acetic AcidHCID 712FormaldehydeHCID 8902DipropylamineHCID 59186147HCID 59186147, compound

Product 1

HCID 44816057HCID 44816057, compound

Sources & evidence

ORD record
ord-6a40c3f64e264facbdfc274fcf7af064
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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