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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 2198069Generated: October 31, 2026

Ethyl Acetate → HCID 57757929, compound

https://huagongshe.com/reaction/2198069

Reaction equation

Participants

RoleNameHCIDCharge
ReactantEthyl AcetateHCID 8857—
ReactantLithium hydrideHCID 62714—
ReactantSodium BicarbonateHCID 516892—
ReactantHCID 57757971HCID 57757971—
SolventTetrahydrofuranHCID 8028—
ProductHCID 57757929HCID 5775792989%

Reaction Steps

To a suspension of lithium hydride (68 mg, 4.0 mmol) in THF (5 mL) under N2 atmosphere was added triethyl phosphonoacetate (498 mg, 2.22 mmol). The mixture was stirred at rt for 30 min and to the reaction mixture was added a slurry of 4-amino-5-(4-nitrophenyl)pyrrolo[2,1-f][1,2,4]triazine-6-carbaldehyde (433 mg, 1.53 mmol) in THF (15 ml). The mixture was heated at reflux for 2 h. After it was cooled to rt, aqueous NaHCO3 was slowly added followed by EtOAc. The organic layer was collected and the aqueous layer was back extracted with EtOAc (2×). The combined organic layers were dried (Na2SO4) and evaporated to give a crude yellow solid that was purified by column chromatography (10:90 to 90:10 v/v EtOAc-hexanes) to afford the title compound (480 mg, 89%). 1H-NMR (CD3OD) δ 8.42 (d, J=8.0 Hz, 2H), 8.17 (s, 1H), 7.88 (s, 1H), 7.68 (d, J=8.0 Hz, 2H), 7.43 (d, J=16 Hz, 1H), 6.36 (d, J=16 Hz, 1H), 4.16 (q, J=7.1 Hz, 2H), 1.23 (t, J=7.1 Hz, 3H); MS [M+H]+=354; LCMS RT=3.12 min.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08338595B2
Source datasetuspto-grants-2012_12
ORD IDord-345e0a8182c4401cbe0812578cadb85a
Source noteuspto-grants-2012_12