HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 886983Generated: October 30, 2026
Triethylamine → 2-Fluoro-5-((3-oxoisobenzofuran-1(3H)-ylidene)methyl)benzonitrile
https://huagongshe.com/reaction/886983
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Triethylamine | HCID 8471 | — |
| Reactant | 2-Fluoro-5-formylbenzonitrile | HCID 2769582 | — |
| Reactant | Dimethyl (3-oxo-1,3-dihydro-2-benzofuran-1-yl)phosphonate | HCID 11118213 | — |
| Solvent | Tetrahydrofuran | HCID 8028 | — |
| Product | 2-Fluoro-5-((3-oxoisobenzofuran-1(3H)-ylidene)methyl)benzonitrile | HCID 67122451 | 96% |
Reaction Steps
To a mixture of (3-oxo-1,3-dihydro-isobenzofuran-1-yl)phosphonic acid dimethyl ester (G) in tetrahydrofuran and 2-fluoro-5-formylbenzonitrile (F) in tetrahydrofuran was added triethylamine drop-wise over 25 min, with the temperature kept below 15° C. The reaction mixture was warmed slowly to 20° C. over 1 hour and concentrated in vacuo. The white residue was slurried in water or 30 minutes, filtered, washed with water, hexane and ether, and dried to yield 2-fluoro-5-(3-oxo-3H-isobenzofuran-1-ylidenemethyl)benzonitrile (E) as a 50:50 mixture of E and Z isomers (yield: 96%).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08247416B2 |
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| Source dataset | uspto-grants-2012_08 |
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| ORD ID | ord-7b324b823f57412ebd1b7ab0d322f379 |
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| Source note | uspto-grants-2012_08 |
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