ChemSpider 2D Image | (10Z,12Z,14S)-14-Pentyloxacyclotetradeca-10,12-dien-2-one | C18H30O2

(10Z,12Z,14S)-14-Pentyloxacyclotetradeca-10,12-dien-2-one

  • Molecular FormulaC18H30O2
  • Average mass278.430 Da
  • Monoisotopic mass278.224579 Da
  • ChemSpider ID21431038

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(10Z,12Z,14S)-14-Pentyloxacyclotetradeca-10,12-dien-2-on [German] [ACD/IUPAC Name]
(10Z,12Z,14S)-14-Pentyloxacyclotetradeca-10,12-dien-2-one [ACD/IUPAC Name]
(10Z,12Z,14S)-14-Pentyloxacyclotétradéca-10,12-dién-2-one [French] [ACD/IUPAC Name]
Oxacyclotetradeca-10,12-dien-2-one, 14-pentyl-, (10Z,12Z,14S)- [ACD/Index Name]
oxacyclotetradeca-10,12-dien-2-one, 14-pentyl-, (10Z,14S)-
(+)-(9Z,11E,13S)-Octadeca-9,11-dien-13-olide

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

Density: 0.9±0.1 g/cm3
Boiling Point: 420.9±34.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.5±3.0 kJ/mol
Flash Point: 177.8±23.1 °C
Index of Refraction: 1.456
Molar Refractivity: 84.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 6.10
ACD/LogD (pH 5.5): 6.38
ACD/BCF (pH 5.5): 41176.71
ACD/KOC (pH 5.5): 69944.07
ACD/LogD (pH 7.4): 6.38
ACD/BCF (pH 7.4): 41176.71
ACD/KOC (pH 7.4): 69944.07
Polar Surface Area: 26 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 29.3±3.0 dyne/cm
Molar Volume: 309.6±3.0 cm3

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