Chloride → HCID 22153237, compound

HRID 98053Notes

Reaction equation

HRID 98053 reaction equation
[CH2:26]([CH:27]=[CH2:28])[Br:29].[CH2:31]([Cl:32])[Cl:33].[CH2:35]([N+:36]([CH2:37][CH3:38])([CH2:39][CH3:40])[CH2:41][CH3:42])[c:43]1[cH:44][cH:45][cH:46][cH:47][cH:48]1.[Cl-:34].[F:3][C:4]([c:5]1[cH:6][c:7]([C:11]2=[C:15]([NH2:16])[CH2:14][CH:13]([c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)[C:12]2=[O:23])[cH:8][cH:9][cH:10]1)([F:24])[F:25].[Na+:2].[OH-:1].[OH2:30]>>[F:3][C:4]([c:5]1[cH:6][c:7]([C:11]2=[C:15]([NH:16][CH2:28][CH:27]=[CH2:26])[CH2:14][CH:13]([c:17]3[cH:18][cH:19][cH:20][cH:21][cH:22]3)[C:12]2=[O:23])[cH:8][cH:9][cH:10]1)([F:24])[F:25]

Participants

9

Reactant 8

HCID 312ChlorideHCID 923Sodium ionHCID 961HydroxideHCID 962WaterHCID 6344DichloromethaneHCID 7841Allyl bromideHCID 17208BenzyltriethylammoniumHCID 156724942-(3-Trifluoromethylphenyl)-3-amino-5-phenyl-2-cyclopentenone

Product 1

HCID 22153237HCID 22153237, compound

Sources & evidence

ORD record
ord-c52d8a0494ee4439bcb35466bc3e9993
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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