1-Ethoxy-4-iodobenzene → 7-(4-Ethoxy-phenylethynyl)-3,3-dimethyl-3,4-dihydro-2H-benzo[b][1,4]dioxepine

HRID 112086

Reaction equation

HRID 112086 reaction equation
[C:1](#[CH:2])[c:3]1[cH:4][c:5]2[c:6]([cH:14][cH:15]1)[O:7][CH2:8][C:9]([CH3:12])([CH3:13])[CH2:10][O:11]2.[CH2:16]([CH3:17])[O:18][c:19]1[cH:20][cH:21][c:22]([I:25])[cH:23][cH:24]1>>[C:1](#[C:2][c:22]1[cH:21][cH:20][c:19]([O:18][CH2:16][CH3:17])[cH:24][cH:23]1)[c:3]1[cH:4][c:5]2[c:6]([cH:14][cH:15]1)[O:7][CH2:8][C:9]([CH3:12])([CH3:13])[CH2:10][O:11]2

Participants

3

Reactant 2

HCID 2207001-Ethoxy-4-iodobenzeneHCID 598526957-Ethynyl-3,3-dimethyl-3,4-dihydro-2H-benzo[b][1,4]dioxepine

Product 1

HCID 113478397-(4-Ethoxy-phenylethynyl)-3,3-dimethyl-3,4-dihydro-2H-benzo[b][1,4]dioxepine

Sources & evidence

ORD record
ord-3792b056065e4ed79c9574ca60320073
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Linked notes

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