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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1032925Generated: October 31, 2026

Acetonitrile → HCID 86747806, compound

https://huagongshe.com/reaction/1032925

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetonitrileHCID 6342—
ReactantPyridine, 4-(trimethylstannyl)-HCID 11128458—
ReactantHCID 13732848HCID 13732848—
CatalystHCID 178418476HCID 178418476—
SolventEthanolHCID 702—
ProductHCID 86747806HCID 86747806—

Reaction Conditions

Temperature150 °C

Reaction Steps

Ethyl (S)-10-bromo-9-fluoro-2,3-dihydro-3-methyl-7-oxo-7H-pyrido[1,2,3-de][1,4]benzoxazine-6-carboxylate (U.S. Pat. No. 4,839,355, Example 5f) (3.50 g), 2.97 g of 4-(trimethylstannyl)pyridine and 0.155 g of dichlorobis(triphenylphosphine)palladium were combined in a Parr apparatus in 200 ml of absolute ethyl alcohol and the mixture under nitrogen was heated at 150° C. for 41/2 hours, allowed to cool slowly and concentrated in vacuo. The concentrate was taken up in chloroform and residues were removed by filtration. The filtrate was extracted with sufficient 1M hydrochloric acid to extract all the product and the aqueous extract was poured onto ice and saturated sodium acetate was added. The resulting mixture was extracted with chloroform and the chloroform extract was washed with brine followed by sodium bicarbonate, dried over magnesium sulfate and concentrated to give, after recrystallization from acetonitrile, 2.56 g of a mixture of the title compound with its corresponding 6-carboxylic acid (73.5% yield); m.p. 249°-252° C. This was combined with 100 mg of the same product obtained previously by an analogous procedure.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS05308843
Source datasetuspto-grants-1994_05
ORD IDord-b5629539ddf84cda8ae4b71c4d95b74c
Source noteuspto-grants-1994_05