Hydrochloric Acid → Hydrochloric Acid

HRID 672283Notes

Reaction equation

HRID 672283 reaction equation
[CH3:1][O:2][C:3]([CH:4]([NH:5][C:6]([O:7][C:8]([CH3:9])([CH3:10])[CH3:11])=[O:12])[CH2:13][c:14]1[cH:15][cH:16][c:17](-[c:20]2[c:21](=[O:32])[n:22]([CH3:31])[c:23]([CH3:30])[cH:24][c:25]2[C:26]([F:27])([F:28])[F:29])[cH:18][cH:19]1)=[O:33].[CH3:41][CH2:42][O:43][CH2:44][CH3:45].[ClH:34].[O:35]1[CH2:36][CH2:37][O:38][CH2:39][CH2:40]1>>[CH3:1][O:2][C:3]([CH:4]([NH2:5])[CH2:13][c:14]1[cH:15][cH:16][c:17](-[c:20]2[c:21](=[O:32])[n:22]([CH3:31])[c:23]([CH3:30])[cH:24][c:25]2[C:26]([F:27])([F:28])[F:29])[cH:18][cH:19]1)=[O:33].[ClH:34]

Participants

6

Reactant 4

HCID 313Hydrochloric AcidHCID 3283Diethyl EtherHCID 312751,4-DioxaneHCID 21334952Methyl 3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)pyridin-3-yl]phenyl]-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate

Product 2

HCID 313Hydrochloric AcidHCID 22382036Methyl 2-amino-3-[4-[1,6-dimethyl-2-oxo-4-(trifluoromethyl)pyridin-3-yl]phenyl]propanoate

Sources & evidence

ORD record
ord-ceb1c5047f5d4aa0adbb72e25d60f66a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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