2-Acetoxy-2-Methylpropyl Methyl 2,6-Dimethyl-4-(2-Nitrophenyl)-1,4-Dihydro-3,5-Pyridinedicarboxylate
[CAS# 106666-00-6]

Identification

• Name: 2-Acetoxy-2-Methylpropyl Methyl 2,6-Dimethyl-4-(2-Nitrophenyl)-1,4-Dihydro-3,5-Pyridinedicarboxylate
• Synonyms: 4-Acetoxynisoldipine
• Molecular Formula: C₂₂H₂₆N₂O₈
• Molecular Weight: 446.45
• CAS Registry Number: 106666-00-6
• SMILES: CC1=C(C(C(=C(N1)C)C(=O)OCC(C)(C)OC(=O)C)c2ccccc2[N+](=O)[O-])C(=O)OC
• InChI: 1S/C22H26N2O8/c1-12-17(20(26)30-6)19(15-9-7-8-10-16(15)24(28)29)18(13(2)23-12)21(27)31-11-22(4,5)32-14(3)25/h7-10,19,23H,11H2,1-6H3
• InChIKey: IVTRFZZAHBRCGQ-UHFFFAOYSA-N

Properties

• Density: 1.246g/cm³ (Cal.)
• Boiling point: 565.96°C at 760 mmHg (Cal.)
• Flash point: 296.082°C (Cal.)
• Refractive index: 1.542 (Cal.)