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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 929506Generated: October 31, 2026

Isonicotinic Acid → HCID 44468933, compound

https://huagongshe.com/reaction/929506

Reaction equation

Participants

RoleNameHCIDCharge
ReactantIsonicotinic AcidHCID 5922—
ReactantHCID 49780164HCID 49780164—
ProductHCID 44468933HCID 44468933—

Reaction Steps

Intermediate 42 (152 mg, 0.5 mmol) was reacted with isonicotinic acid by Method E. Flash chromatography eluted with 9:1 DCM:MeOH afforded compound 47 (204 mg, 100%) as a white solid: Mp 210-212° C. 1H NMR (500 MHz, DMSO-d6) δ 8.67 (d, J=6 Hz, 2H), 8.59 (s, 1H), 7.47 (d, J=9 Hz, 2H), 7.38 (d, J=6 Hz, 2H), 7.22 (d, J=9 Hz, 2H), 6.25 (d, J=8 Hz, 1H), 4.30 (d, J=12 Hz, 1H), 3.76 (s, 1H), 3.41 (d, J=12 Hz, 1H), 3.16 (t, J=12 Hz, 1H), 3.05 (t, J=12 Hz, 1H), 1.97-1.88 (m, 1H), 1.84-1.75 (m, 1H), 1.47-1.29 (m, 2H). Purity 92%. HRMS calculated for C19H19F3N4O3−H+ 407.1331. found (ESI(−), [M−H]) 407.1316.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS09296693B2
Source datasetuspto-grants-2016_03
ORD IDord-9b36006ed0254f9ea2c2d86126ef97a3
Source noteuspto-grants-2016_03