[2-Butyl-2,11-dimethyl-11-(pyridin-3-ylcarbonyloxymethyl)pentadecyl] pyridine-3-carboxylate
[CAS# 85018-82-2]

Identification

• Name: [2-Butyl-2,11-dimethyl-11-(pyridin-3-ylcarbonyloxymethyl)pentadecyl] pyridine-3-carboxylate
• Synonyms: 3-Pyridinecarboxylic Acid [2-Butyl-2,11-Dimethyl-11-[[Oxo-(3-Pyridyl)Methoxy]Methyl]Pentadecyl] Ester; Nicotinic Acid [2-Butyl-2,11-Dimethyl-11-(Pyridine-3-Carbonyloxymethyl)Pentadecyl] Ester; [2-Butyl-2,11-Dimethyl-11-(Pyridin-3-Ylcarbonyloxymethyl)Pentadecyl] Pyridine-3-Carboxylate
• Molecular Formula: C₃₄H₅₂N₂O₄
• Molecular Weight: 552.80
• CAS Registry Number: 85018-82-2
• SMILES: C1=NC=CC=C1C(=O)OCC(CCCCCCCCC(COC(C2=CC=CN=C2)=O)(C)CCCC)(C)CCCC
• InChI: 1S/C34H52N2O4/c1-5-7-19-33(3,27-39-31(37)29-17-15-23-35-25-29)21-13-11-9-10-12-14-22-34(4,20-8-6-2)28-40-32(38)30-18-16-24-36-26-30/h15-18,23-26H,5-14,19-22,27-28H2,1-4H3
• InChIKey: KFLGWXWLBWGDKC-UHFFFAOYSA-N

Properties

• Density: 1.018g/cm³ (Cal.)
• Boiling point: 618.244°C at 760 mmHg (Cal.)
• Flash point: 327.702°C (Cal.)