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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2100465Generated: October 30, 2026

Acetonitrile → HCID 135899298, compound

https://huagongshe.com/reaction/2100465

Reaction equation

Participants

RoleNameHCIDCharge
ReactantAcetonitrileHCID 6342—
Reactant3-(4-Methoxyphenyl)-1-propanolHCID 79406—
ReactantPotassium tert-butoxideHCID 23665647—
ReactantHCID 178517828HCID 178517828—
SolventDimethyl SulfoxideHCID 679—
SolventTrifluoroacetic acidHCID 6422—
ProductHCID 135899298HCID 135899298—

Reaction Conditions

Temperature120 °C

Reaction Steps

In a screw-capped glass tube, 3-(4-methoxyphenyl)-1-propanol ([5406-18-8], 137 mg, 0.826 mmol) was added to a mixture of 2-chloropyrido[2,3-d]pyrimidin-4(1H)-one ([93049-38-8], 50 mg, 0.28 mmol) and KOtBu (62 mg, 0.55 mmol) in DMSO (2 ml). The mixture was heated (3 days, 120° C.) and the title compound was isolated from the product mixture by reversed-phase, preparative HPLC (Agilent Zorbax XdB C18 column, solvent gradient 5-95% CH3CN in 0.1% TFA(aq) over 7 min, flow rate 30 ml/min). MS: m/e=310.5 [M−H−], 1H NMR (d6-DMSO): δ 2.02 (dd, 2H), 3.36 (d, 2H), 3.71 (s, 3H), 4.42 (d, 2H), 6.86 (d, 2H), 7.15 (d, 2H), 7.36 (dd, 1H), 8.38 (d, 1H), 8.79 (d, 1H).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07572801B2
Source datasetuspto-grants-2009_08
ORD IDord-068c881b690c45889f35cf091ec9256e
Source noteuspto-grants-2009_08