Acetate → Hydrochloric Acid

HRID 187600Notes

Reaction equation

HRID 187600 reaction equation
[C:11]([CH3:12])([CH3:13])([CH3:14])[NH:15][CH2:16][C:17](=[O:18])[c:19]1[cH:20][c:21]([OH:36])[c:22]([O:25][C:26]([c:27]2[cH:28][cH:29][c:30]([O:33][CH3:34])[cH:31][cH:32]2)=[O:35])[cH:23][cH:24]1.[CH3:1][C:2](=[O:3])[OH:4].[CH3:37][N:38]([CH3:39])[CH:40]=[O:41].[CH3:5][C:6](=[O:7])[O-:8].[ClH:10].[ClH:9]>>[C:11]([CH3:12])([CH3:13])([CH3:14])[NH:15][CH2:16][CH:17]([OH:18])[c:19]1[cH:20][c:21]([OH:36])[c:22]([O:25][C:26]([c:27]2[cH:28][cH:29][c:30]([O:33][CH3:34])[cH:31][cH:32]2)=[O:35])[cH:23][cH:24]1.[ClH:9]

Participants

7

Reactant 5

HCID 175AcetateHCID 176Acetic AcidHCID 313Hydrochloric Acid2×HCID 6228DimethylformamideHCID 122950263-Hydroxy-4-(p-anisoyloxy)phenyl tert-butylaminomethyl ketone

Product 2

HCID 313Hydrochloric AcidHCID 12295076[4-[2-(Tert-butylamino)-1-hydroxyethyl]-2-hydroxyphenyl] 4-methoxybenzoate

Sources & evidence

ORD record
ord-81a96e97ca29480b86e49bae3b7886a7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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