2-[5-Methoxycarbonyl-2,6-Dimethyl-4-(3-Nitrophenyl)1,4-Dihydropyridine-3-Carbonyl]Oxyacetic Acid
[CAS# 104305-95-5]

Identification

• Name: 2-[5-Methoxycarbonyl-2,6-Dimethyl-4-(3-Nitrophenyl)1,4-Dihydropyridine-3-Carbonyl]Oxyacetic Acid
• Synonyms: 2-[[5-Methoxycarbonyl-2,6-Dimethyl-4-(3-Nitrophenyl)-1,4-Dihydropyridin-3-Yl]-Oxomethoxy]Acetic Acid; 2-[5-Carbomethoxy-2,6-Dimethyl-4-(3-Nitrophenyl)1,4-Dihydropyridine-3-Carbonyl]Oxyacetic Acid; 2-[[5-Methoxycarbonyl-2,6-Dimethyl-4-(3-Nitrophenyl)-1,4-Dihydropyridin-3-Yl]Carbonyloxy]Ethanoic Acid
• Molecular Formula: C₁₈H₁₈N₂O₈
• Molecular Weight: 390.35
• CAS Registry Number: 104305-95-5
• SMILES: C1=C([N+]([O-])=O)C=CC=C1C2C(=C(NC(=C2C(OC)=O)C)C)C(OCC(=O)O)=O
• InChI: 1S/C18H18N2O8/c1-9-14(17(23)27-3)16(11-5-4-6-12(7-11)20(25)26)15(10(2)19-9)18(24)28-8-13(21)22/h4-7,16,19H,8H2,1-3H3,(H,21,22)
• InChIKey: HWGRWZAHCKCUSI-UHFFFAOYSA-N

Properties

• Density: 1.377g/cm³ (Cal.)
• Boiling point: 576.824°C at 760 mmHg (Cal.)
• Flash point: 302.652°C (Cal.)