1-Ethynyl-4-nitrobenzene → 5-(4-Nitro-phenyl)-pent-2-en-4-ynoic acid ethyl ester

HRID 690515Notes

Reaction equation

HRID 690515 reaction equation
[C:1](#[CH:2])[c:3]1[cH:4][cH:5][c:6]([N+:9](=[O:10])[O-:11])[cH:7][cH:8]1.[CH2:12]([CH3:13])[O:14][C:15]([CH:16]=[CH:17][I:18])=[O:19]>>[C:1](#[C:2][CH:17]=[CH:16][C:15]([O:14][CH2:12][CH3:13])=[O:19])[c:3]1[cH:4][cH:5][c:6]([N+:9](=[O:10])[O-:11])[cH:7][cH:8]1

Participants

3

Reactant 2

HCID 1367521-Ethynyl-4-nitrobenzeneHCID 4184066(Z)-Ethyl 3-iodoacrylate

Product 1

HCID 765565105-(4-Nitro-phenyl)-pent-2-en-4-ynoic acid ethyl ester

Sources & evidence

ORD record
ord-4c6793f229f34097bd80f1f1511c190c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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