ALKANE C56

The Hexapentacontane, with the CAS registry number 7719-82-6, is also known as n-Hexapentacontane. This chemical's molecular formula is C₅₆H₁₁₄ and molecular weight is 787.5. What's more, its systematic name is Hexapentacontane. In addition, the dust of this chemical can not be breathed. And you should avoid contacting with skin and eyes.

Physical properties about Hexapentacontane are: (1)ACD/LogP: 30.51; (2)# of Rule of 5 Violations: 2; (3)#H bond acceptors: 0; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 53; (6)Polar Surface Area: 0 Å²; (7)Index of Refraction: 1.461; (8)Molar Refractivity: 261.48 cm³; (9)Molar Volume: 952.9 cm³; (10)Polarizability: 103.66×10^-24 cm³; (11)Surface Tension: 31.6 dyne/cm; (12)Density: 0.826 g/cm³; (13)Flash Point: 565.7 °C; (14)Enthalpy of Vaporization: 86.61 kJ/mol; (15)Boiling Point: 604.7 °C at 760 mmHg; (16)Vapour Pressure: 6.25E-14 mmHg at 25 °C.

Preparation of Hexapentacontane: this chemical is prepared by 1-Bromohexapentacontane. The reaction needs reagent Lithium triethylborohydride and solvent Tetrahydrofuran. The reaction time is 15 minutes with reaction temperature of 20 °C. The yield is about 34 %.

You can still convert the following datas into molecular structure:
(1) SMILES: C(CCCCCCCCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC
(2) InChI: InChI=1/C56H114/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39-41-43-45-47-49-51-53-55-56-54-52-50-48-46-44-42-40-38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-56H2,1-2H3
(3) InChIKey: FIUOBKZPFQPHFG-UHFFFAOYAP