Acetic Acid → HCID 85123181, compound

HRID 2142263Notes

Reaction equation

HRID 2142263 reaction equation
[CH2:23]1[CH2:24][CH2:25][NH:26][CH2:27][CH2:28]1.[CH3:29][C:30](=[O:31])[OH:32].[CH3:44][c:45]1[cH:46][cH:47][cH:48][cH:49][cH:50]1.[Cl:33][c:34]1[cH:35][cH:36][c:37]([OH:42])[c:38]([CH:39]=[O:40])[cH:41]1.[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]2[C:8](=[O:13])[S:9][CH2:10][C:11]2=[O:12])[cH:14][c:15]([C:17]([F:18])([F:19])[F:20])[cH:16]1)([F:21])[F:22].[OH2:43]>>[F:1][C:2]([c:3]1[cH:4][c:5]([CH2:6][N:7]2[C:8](=[O:13])[S:9][C:10](=[CH:39][c:38]3[c:37]([OH:42])[cH:36][cH:35][c:34]([Cl:33])[cH:41]3)[C:11]2=[O:12])[cH:14][c:15]([C:17]([F:18])([F:19])[F:20])[cH:16]1)([F:21])[F:22]

Participants

7

Reactant 6

HCID 176Acetic AcidHCID 962WaterHCID 1140TolueneHCID 8082PiperidineHCID 124815-Chloro-salicylaldehydeHCID 23069953HCID 23069953, compound

Product 1

HCID 85123181HCID 85123181, compound

Sources & evidence

ORD record
ord-057458119d554a2aa4760810475ee637
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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