Chloride → Pyridine, 5-(1-bromoethyl)-2-(trifluoromethyl)-

HRID 308379Notes

Reaction equation

HRID 308379 reaction equation
[Br:1][N:2]1[C:3](=[O:4])[CH2:5][CH2:6][C:7]1=[O:8].[CH2:15]([CH3:16])[c:17]1[cH:18][cH:19][c:20]([C:23]([F:24])([F:25])[F:26])[n:21][cH:22]1.[CH2:39]([Cl:40])[Cl:41].[CH3:27][CH2:28][CH2:29][CH2:30][CH2:31][CH3:32].[CH3:33][CH2:34][O:35][C:36]([CH3:37])=[O:38].[Cl-:42].[Cl-:43].[Cl-:44].[Cl-:45].[Zr+4:46].[n:9]1[cH:10][cH:11][cH:12][cH:13][cH:14]1>>[Br:1][CH:15]([CH3:16])[c:17]1[cH:18][cH:19][c:20]([C:23]([F:24])([F:25])[F:26])[n:21][cH:22]1

Participants

9

Reactant 8

HCID 312Chloride4×HCID 1049PyridineHCID 6344DichloromethaneHCID 8058HexaneHCID 8857Ethyl AcetateHCID 67184N-bromobutanimideHCID 115139Zirconium cation (4+)HCID 216537205-Ethyl-2-(trifluoromethyl)pyridin

Product 1

HCID 44227572Pyridine, 5-(1-bromoethyl)-2-(trifluoromethyl)-

Sources & evidence

ORD record
ord-d8190504fa6348d68a91ae7de97ddbf3
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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