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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 178846292Generated: October 30, 2026

ethyl 2-oxo-4-phenyl-6-propyl-3,4-dihydro-1H-pyrimidine-5-carboxylate

5-Pyrimidinecarboxylic acid, 1,2,3,4-tetrahydro-2-oxo-4-phenyl-6-propyl-, ethyl ester · 5-Pyrimidinecarboxylicacid,1,2,3,4-tetrahydro-2-oxo-4-phenyl-6-propyl-,ethylester(9CI)

https://huagongshe.com/en/chemical/178846292

ethyl 2-oxo-4-phenyl-6-propyl-3,4-dihydro-1H-pyrimidine-5-carboxylate molecular structure

Identifiers & Physical Properties

CAS No.401648-34-8
Molecular formulaC16H20N2O3
Average molar mass288.34 g/mol
SMILESCCCC1=C(C(=O)OCC)C(c2ccccc2)NC(=O)N1
InChIKeyCDNKFSNDBNWQLC-UHFFFAOYSA-N

Chemical & Physical Properties

XLogP2.2
Topological polar surface area67.4
Hydrogen bond donors2
Hydrogen bond acceptors3
Rotatable bonds6
Heavy atoms21
Formal charge0
Complexity425
Melting point162-165 °C(Solv: dichloromethane (75-09-2))
Boiling point412.4±45.0 °C(Predicted)
Density1.123±0.06 g/cm3(Predicted)
pKa (acidity coefficient)11.34±0.70(Predicted)