Chloride → tert-butyl N-(4,4-dichloro-3-oxo-1-phenylbutan-2-yl)carbamate

HRID 105909Notes

Reaction equation

HRID 105909 reaction equation
[C:14]([CH3:15])([CH3:16])([CH3:17])[O:18][C:19](=[O:20])[NH:21][CH:22]([C:23]([O:25][CH3:24])=[O:26])[CH2:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1.[CH2:45]1[O:46][CH2:47][CH2:48][CH2:49]1.[CH2:9]([Mg+:10])[CH2:11][CH2:12][CH3:13].[CH3:38][CH2:39][O:40][C:41](=[O:42])[CH3:43].[CH:1]([NH:2][CH:3]([CH3:4])[CH3:5])([CH3:6])[CH3:7].[Cl-:8].[Cl:34][CH2:35][Cl:36].[ClH:37].[OH2:44]>>[C:14]([CH3:15])([CH3:16])([CH3:17])[O:18][C:19](=[O:20])[NH:21][CH:22]([C:23](=[O:25])[CH:35]([Cl:34])[Cl:36])[CH2:27][c:28]1[cH:29][cH:30][cH:31][cH:32][cH:33]1

Participants

10

Reactant 9

HCID 312ChlorideHCID 313Hydrochloric AcidHCID 962WaterHCID 6344DichloromethaneHCID 7912DiisopropylamineHCID 8028TetrahydrofuranHCID 8857Ethyl AcetateHCID 3786800Boc-DL-phenylalanine methyl esterHCID 178448190HCID 178448190, compound

Product 1

HCID 9862412tert-butyl N-(4,4-dichloro-3-oxo-1-phenylbutan-2-yl)carbamate

Sources & evidence

ORD record
ord-66062483fb804bba9bcaf3b9feca5c10
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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