Chloride → 1,1-Difluoro-2,2-dimethyl-3-[3-(N-phenyl-N-acetylamino)-4-fluorobenzyloxy]propane

HRID 97217

Reaction equation

HRID 97217 reaction equation
[C:18]([CH3:19])(=[O:20])[NH:21][c:22]1[cH:23][cH:24][cH:25][cH:26][cH:27]1.[C:29](=[O:30])([O-:31])[O-:32].[CH3:35][O:36][CH2:37][CH2:38][O:39][CH2:40][CH2:41][N:42]([CH2:43][CH2:44][O:45][CH2:46][CH2:47][O:48][CH3:49])[CH2:50][CH2:51][O:52][CH2:53][CH2:54][O:55][CH3:56].[CH3:57][CH2:58][O:59][C:60](=[O:61])[CH3:62].[CH3:63][N:64]([CH3:65])[CH:66]=[O:67].[Cl-:28].[F:1][CH:2]([C:3]([CH2:4][O:5][CH2:6][c:7]1[cH:8][c:9]([Br:14])[c:10]([F:13])[cH:11][cH:12]1)([CH3:15])[CH3:16])[F:17].[K+:33].[K+:34]>>[F:1][CH:2]([C:3]([CH2:4][O:5][CH2:6][c:7]1[cH:8][c:9]([N:21]([C:18]([CH3:19])=[O:20])[c:22]2[cH:23][cH:24][cH:25][cH:26][cH:27]2)[c:10]([F:13])[cH:11][cH:12]1)([CH3:15])[CH3:16])[F:17]

Participants

9

Reactant 8

HCID 312ChlorideHCID 813Potassium Cation2×HCID 904AcetanilideHCID 6228DimethylformamideHCID 8857Ethyl AcetateHCID 19660Carbonate IonHCID 112414Ethanamine, 2-(2-methoxyethoxy)-N,N-bis[2-(2-methoxyethoxy)ethyl]-HCID 212810781,1-Difluoro-2,2-dimethyl-3-(3-bromo-4-fluorobenzyloxy)propane

Product 1

HCID 212810891,1-Difluoro-2,2-dimethyl-3-[3-(N-phenyl-N-acetylamino)-4-fluorobenzyloxy]propane

Sources & evidence

ORD record
ord-80b735592fa142f4bb443dc95143d8c1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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