[1,3-Bis(Acetyloxymethyl)-2,4,6-Trioxo-5-(1-Phenylethyl)-1,3-Diazinan-5-Yl] Propanoate
[CAS# 37431-43-9]

Identification

• Name: [1,3-Bis(Acetyloxymethyl)-2,4,6-Trioxo-5-(1-Phenylethyl)-1,3-Diazinan-5-Yl] Propanoate
• Synonyms: [1,3-Bis(Acetoxymethyl)-2,4,6-Trioxo-5-(1-Phenylethyl)Hexahydropyrimidin-5-Yl] Propanoate; Propanoic Acid [1,3-Bis(Acetoxymethyl)-2,4,6-Trioxo-5-(1-Phenylethyl)-5-Hexahydropyrimidinyl] Ester; Propionic Acid [1,3-Bis(Acetoxymethyl)-2,4,6-Triketo-5-(1-Phenylethyl)Hexahydropyrimidin-5-Yl] Ester
• Molecular Formula: C₂₁H₂₄N₂O₉
• Molecular Weight: 448.43
• CAS Registry Number: 37431-43-9
• SMILES: C1=CC=CC=C1C(C2(C(N(C(N(C2=O)COC(=O)C)=O)COC(=O)C)=O)OC(CC)=O)C
• InChI: 1S/C21H24N2O9/c1-5-17(26)32-21(13(2)16-9-7-6-8-10-16)18(27)22(11-30-14(3)24)20(29)23(19(21)28)12-31-15(4)25/h6-10,13H,5,11-12H2,1-4H3
• InChIKey: LTBWEGNSTWPSDA-UHFFFAOYSA-N

Properties

• Density: 1.359g/cm³ (Cal.)
• Boiling point: 540.197°C at 760 mmHg (Cal.)
• Flash point: 280.501°C (Cal.)