Acetic Acid → HCID 22643459, compound

HRID 1114461Notes

Reaction equation

HRID 1114461 reaction equation
[CH3:25][C:26](=[O:27])[OH:28].[CH3:30][OH:31].[Cl:15][c:16]1[c:17]([CH2:18][NH2:19])[cH:20][cH:21][c:22]([Cl:24])[cH:23]1.[O:1]=[C:2]1[CH2:3][CH2:4][N:5]([C:8](=[O:9])[O:10][C:11]([CH3:12])([CH3:13])[CH3:14])[CH2:6][CH2:7]1.[OH2:29]>>[CH:2]1([NH:19][CH2:18][c:17]2[c:16]([Cl:15])[cH:23][c:22]([Cl:24])[cH:21][cH:20]2)[CH2:3][CH2:4][N:5]([C:8](=[O:9])[O:10][C:11]([CH3:12])([CH3:13])[CH3:14])[CH2:6][CH2:7]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 887MethanolHCID 962WaterHCID 14852,4-DichlorobenzylamineHCID 735900tert-Butyl 4-oxopiperidine-1-carboxylate

Product 1

HCID 22643459HCID 22643459, compound

Sources & evidence

ORD record
ord-a1d44a46f95a4266b80b6c66cfaea6d8
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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