Molecular FormulaC17H30O2 Average mass266.419 Da Monoisotopic mass266.224579 Da couchsurfingcook.com ID10660411


You are watching: 5-butyl-2 2-dimethylnonane

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Systematic name

5-sec-Butyl-2-(2,4-dimethyl-3-cyclohexen-1-yl)-5-methyl-1,3-dioxane

SMILES

CC(CC)C1(C)COC(OC1)C2CCC(/C)=CC2C CopyCopied

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CSID:10660411, http://www.couchsurfingcook.com/Chemical-Structure.10660411.html (accessed 02:31, Oct 14, 2021) CopyCopied


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Density: 0.9±0.1 g/cm3
Boiling Point: 329.9±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 55.0±3.0 kJ/mol
Flash Point: 165.8±23.5 °C
Index of Refraction: 1.466
Molar Refractivity: 79.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 1

ACD/LogP: 5.36
ACD/LogD (pH 5.5): 5.05
ACD/BCF (pH 5.5): 4088.83
ACD/KOC (pH 5.5): 13389.88
ACD/LogD (pH 7.4): 5.05
ACD/BCF (pH 7.4): 4088.83
ACD/KOC (pH 7.4): 13389.88
Polar Surface Area: 18 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 28.8±3.0 dyne/cm
Molar Volume: 287.0±3.0 cm3

Predicted data is generated using the US Environmental Protection Agency’s EPISuite™

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