Water → HCID 67363953, compound

HRID 1148011Notes

Reaction equation

HRID 1148011 reaction equation
[CH2:34]1[CH2:35][CH2:36][NH:37][CH2:38][CH2:39]1.[CH3:28][CH2:29][O:30][C:31]([CH3:32])=[O:33].[Cl:12][c:13]1[cH:14][cH:15][c:16](-[c:19]2[cH:20][cH:21][c:22]([C:25]#[CH:26])[n:23][cH:24]2)[cH:17][cH:18]1.[Cu:40][I:41].[I:1][c:2]1[cH:3][cH:4][c:5]([O:6][CH2:7][CH2:8][OH:9])[cH:10][cH:11]1.[OH2:27]>>[c:2]1([C:26]#[C:25][c:22]2[cH:21][cH:20][c:19](-[c:16]3[cH:15][cH:14][c:13]([Cl:12])[cH:18][cH:17]3)[cH:24][n:23]2)[cH:3][cH:4][c:5]([O:6][CH2:7][CH2:8][OH:9])[cH:10][cH:11]1

Participants

7

Reactant 6

HCID 962WaterHCID 8082PiperidineHCID 8857Ethyl AcetateHCID 24350Copper(1+) iodide; Copper(I) iodide; Cuprous iodide; Cuprous iodide (CuI)HCID 35132082-(4-Iodophenoxy)ethanolHCID 578453285-(4-Chloro-phenyl)-2-ethynyl-pyridine

Product 1

HCID 67363953HCID 67363953, compound

Sources & evidence

ORD record
ord-8b501c20f9434ba9820d12dfb2ed9161
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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