O3-Ethyl O5-Methyl 2-(Imidazol-1-Ylmethyl)-6-Methyl-4-(3-Nitrophenyl)-1,4-Dihydropyridine-3,5-Dicarboxylate
[CAS# 103417-69-2]

Identification

• Name: O3-Ethyl O5-Methyl 2-(Imidazol-1-Ylmethyl)-6-Methyl-4-(3-Nitrophenyl)-1,4-Dihydropyridine-3,5-Dicarboxylate
• Synonyms: 2-(1-Imidazolylmethyl)-6-Methyl-4-(3-Nitrophenyl)-1,4-Dihydropyridine-3,5-Dicarboxylic Acid O3-Ethyl O5-Methyl Ester; 2-(Imidazol-1-Ylmethyl)-6-Methyl-4-(3-Nitrophenyl)-1,4-Dihydropyridine-3,5-Dicarboxylic Acid O3-Ethyl O5-Methyl Ester; 1,4-Dihydro-2-(Imidazol-1-Yl-Methyl)-6-Methyl-4-(3-Nitrophenyl)Pyridine-3,5-Dicarboxylic Acid 3-Ethyl 5-Methyl Diester
• Molecular Formula: C₂₁H₂₂N₄O₆
• Molecular Weight: 426.43
• CAS Registry Number: 103417-69-2
• SMILES: C1=CN=C[N]1CC2=C(C(OCC)=O)C(C(=C(N2)C)C(=O)OC)C3=CC(=CC=C3)[N+]([O-])=O
• InChI: 1S/C21H22N4O6/c1-4-31-21(27)19-16(11-24-9-8-22-12-24)23-13(2)17(20(26)30-3)18(19)14-6-5-7-15(10-14)25(28)29/h5-10,12,18,23H,4,11H2,1-3H3
• InChIKey: BFLKGKGRZKABHQ-UHFFFAOYSA-N

Properties

• Density: 1.352g/cm³ (Cal.)
• Boiling point: 613.346°C at 760 mmHg (Cal.)
• Flash point: 324.74°C (Cal.)