ChemSpider 2D Image | (3S,11R)-3,11-Dimethyl-1-octacosene | C30H60

(3S,11R)-3,11-Dimethyl-1-octacosene

  • Molecular FormulaC30H60
  • Average mass420.797 Da
  • Monoisotopic mass420.469513 Da
  • ChemSpider ID74109004

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

(3S,11R)-3,11-Dimethyl-1-octacosen [German] [ACD/IUPAC Name]
(3S,11R)-3,11-Dimethyl-1-octacosene [ACD/IUPAC Name]
(3S,11R)-3,11-Diméthyl-1-octacosène [French] [ACD/IUPAC Name]
1-Octacosene, 3,11-dimethyl-, (3S,11R)- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 0.8±0.1 g/cm3
Boiling Point: 485.9±12.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 72.3±0.8 kJ/mol
Flash Point: 275.0±11.7 °C
Index of Refraction: 1.454
Molar Refractivity: 140.7±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 25
#Rule of 5 Violations: 1
ACD/LogP: 15.82
ACD/LogD (pH 5.5): 13.95
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 13.95
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 0 Å2
Polarizability: 55.8±0.5 10-24cm3
Surface Tension: 29.4±3.0 dyne/cm
Molar Volume: 519.6±3.0 cm3

Click to predict properties on the Chemicalize site


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