Acetic Acid → HCID 54543583, compound

HRID 185596Notes

Reaction equation

HRID 185596 reaction equation
[C:31]([OH:32])(=[O:33])[CH3:34].[CH2:10]([CH3:11])[O:12][C:13]([CH2:14][C:15](=[O:16])[CH2:17][O:18][CH2:19][CH2:20][Cl:21])=[O:22].[CH3:23][C:24](=[O:25])[OH:26].[CH:27]([OH:28])([CH3:29])[CH3:30].[Cl:1][c:2]1[c:3]([CH:4]=[O:5])[cH:6][cH:7][cH:8][cH:9]1.[NH:35]1[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]1>>[Cl:1][c:2]1[c:3]([CH:4]=[C:14]([C:13]([O:12][CH2:10][CH3:11])=[O:22])[C:15](=[O:16])[CH2:17][O:18][CH2:19][CH2:20][Cl:21])[cH:6][cH:7][cH:8][cH:9]1

Participants

6

Reactant 5

HCID 176Acetic Acid2×HCID 3776IsopropanolHCID 69962-ChlorobenzaldehydeHCID 8082PiperidineHCID 15428861HCID 15428861, compound

Product 1

HCID 54543583HCID 54543583, compound

Sources & evidence

ORD record
ord-de6bb4efac094e39ab1258e150081f25
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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