ChemSpider 2D Image | 3,7-Dimethyl-1,6-octadien-3-yl 3-methylbutanoate | C15H26O2

3,7-Dimethyl-1,6-octadien-3-yl 3-methylbutanoate

  • Molecular FormulaC15H26O2
  • Average mass238.366 Da
  • Monoisotopic mass238.193283 Da
  • ChemSpider ID21428249

More details:

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

3,7-Dimethyl-1,6-octadien-3-yl 3-methylbutanoate [ACD/IUPAC Name]
3,7-Dimethyl-1,6-octadien-3-yl-3-methylbutanoat [German] [ACD/IUPAC Name]
3-Méthylbutanoate de 3,7-diméthyl-1,6-octadién-3-yle [French] [ACD/IUPAC Name]
Butanoic acid, 3-methyl-, 1-ethenyl-1,5-dimethyl-4-hexen-1-yl ester [ACD/Index Name]
1118-27-0 [RN]
214-259-4 [EINECS]
Linalyl isovalerate
UNII-1X8S4K3UQ9

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

Density: 0.9±0.1 g/cm3
Boiling Point: 279.5±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.8±3.0 kJ/mol
Flash Point: 75.8±17.1 °C
Index of Refraction: 1.455
Molar Refractivity: 72.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 5.24
ACD/LogD (pH 5.5): 4.72
ACD/BCF (pH 5.5): 2259.10
ACD/KOC (pH 5.5): 8756.75
ACD/LogD (pH 7.4): 4.72
ACD/BCF (pH 7.4): 2259.10
ACD/KOC (pH 7.4): 8756.75
Polar Surface Area: 26 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 28.1±3.0 dyne/cm
Molar Volume: 268.6±3.0 cm3

Click to predict properties on the Chemicalize site


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