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Hexadecane,2,6,11,15-tetramethyl-

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  • Name Hexadecane,2,6,11,15-tetramethyl-
  • EINECSN/A
  • CAS No. 504-44-9
  • Density0.784 g/cm3
  • PSA0.00000
  • LogP7.47160
  • SolubilityN/A
  • Melting PointN/A
  • FormulaC20H42
  • Boiling Point322.9 °C at 760 mmHg
  • Molecular Weight282.553
  • Flash Point150.4 °C
  • Transport InformationN/A
  • AppearanceN/A
  • Safety
  • Risk CodesN/A
  • Molecular Structure
    Molecular Structure of 504-44-9 (2,6,11,15-TETRAMETHYLHEXADECANE)
  • Hazard SymbolsN/A
  • SynonymsN/A

Hexadecane,2,6,11,15-tetramethyl- Specification

The CAS registry number of Hexadecane,2,6,11,15-tetramethyl- is 504-44-9. This chemical's molecular formula is C20H42 and molecular weight is 282.55. What's more, both its IUPAC name and systematic name are the same which is called 2,6,11,15-Tetramethylhexadecane.

Physical properties about Hexadecane,2,6,11,15-tetramethyl- are: (1)ACD/LogP: 10.65; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 10.65; (4)ACD/LogD (pH 7.4): 10.65; (5)ACD/BCF (pH 5.5): 1000000; (6)ACD/BCF (pH 7.4): 1000000; (7)ACD/KOC (pH 5.5): 10000000; (8)ACD/KOC (pH 7.4): 10000000; (9)#H bond acceptors: 0; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 13; (12)Index of Refraction: 1.437; (13)Molar Refractivity: 94.54 cm3; (14)Molar Volume: 360.1 cm3; (15)Polarizability: 37.47×10-24 cm3; (16)Surface Tension: 26.5 dyne/cm; (17)Density: 0.784 g/cm3; (18)Flash Point: 150.4 °C; (19)Enthalpy of Vaporization: 54.24 kJ/mol; (20)Boiling Point: 322.9 °C at 760 mmHg; (21)Vapour Pressure: 0.00051 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: C(CCC(CCCC(C)C)C)CC(C)CCCC(C)C
(2)InChI: InChI=1/C20H42/c1-17(2)11-9-15-19(5)13-7-8-14-20(6)16-10-12-18(3)4/h17-20H,7-16H2,1-6H3
(3)InChIKey: KKFZXXATNGJPJS-UHFFFAOYAC

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