Acetic Acid → HCID 18357149, compound

HRID 198438Notes

Reaction equation

HRID 198438 reaction equation
[C:28]([O:29][BH-:30]([O:31][C:32](=[O:33])[CH3:34])[O:35][C:36](=[O:37])[CH3:38])(=[O:39])[CH3:40].[CH3:46][C:47](=[O:48])[OH:49].[Cl:43][CH2:44][Cl:45].[ClH:42].[Na+:41].[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][cH:10][c:11]([CH:12]=[O:13])[cH:14][cH:15]1.[n:16]1[cH:17][cH:18][c:19]([N:22]2[CH2:23][CH2:24][NH:25][CH2:26][CH2:27]2)[cH:20][cH:21]1>>[O:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[c:8]1[cH:9][cH:10][c:11]([N:25]2[CH2:24][CH2:23][N:22]([c:19]3[cH:18][cH:17][n:16][cH:21][cH:20]3)[CH2:27][CH2:26]2)[cH:14][cH:15]1

Participants

8

Reactant 7

HCID 176Acetic AcidHCID 313Hydrochloric AcidHCID 923Sodium ionHCID 6344DichloromethaneHCID 661394-PhenoxybenzaldehydeHCID 705171-(4-Pyridyl)piperazineHCID 2724942Triacetoxyborohydride

Product 1

HCID 18357149HCID 18357149, compound

Sources & evidence

ORD record
ord-4caad0ee410144fab6c1a80fb085d629
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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