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Search term: 103882800 (Found by CSID)

ChemSpider 2D Image | (5S)-5-Methyl-3-(11Z,15Z,19Z)-11,15,19-triacontatrien-1-yl-2(5H)-furanone | C35H60O2

(5S)-5-Methyl-3-(11Z,15Z,19Z)-11,15,19-triacontatrien-1-yl-2(5H)-furanone

  • Molecular FormulaC35H60O2
  • Average mass512.850 Da
  • Monoisotopic mass512.459351 Da
  • ChemSpider ID103882800
  • 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

(5S)-5-Methyl-3-(11Z,15Z,19Z)-11,15,19-triacontatrien-1-yl-2(5H)-furanone
(5S)-5-Methyl-3-[(11Z,15Z,19Z)-11,15,19-triacontatrien-1-yl]-2(5H)-furanon [German] [ACD/IUPAC Name]
(5S)-5-Methyl-3-[(11Z,15Z,19Z)-11,15,19-triacontatrien-1-yl]-2(5H)-furanone [ACD/IUPAC Name]
(5S)-5-Méthyl-3-[(11Z,15Z,19Z)-11,15,19-triacontatrién-1-yl]-2(5H)-furanone [French] [ACD/IUPAC Name]
2(5H)-Furanone, 5-methyl-3-[(11Z,15Z,19Z)-11,15,19-triacontatrien-1-yl]-, (5S)- [ACD/Index Name]
206131-73-9 [RN]
(2S)-2-methyl-4-[(11Z,15Z,19Z)-triaconta-11,15,19-trienyl]-2H-furan-5-one
Chatenaytrienin-1

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

Density: 0.9±0.1 g/cm3
Boiling Point: 611.5±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.8±3.0 kJ/mol
Flash Point: 256.5±20.3 °C
Index of Refraction: 1.488
Molar Refractivity: 163.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 26
#Rule of 5 Violations: 2
ACD/LogP: 13.85
ACD/LogD (pH 5.5): 12.51
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 12.51
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 26 Å2
Polarizability: 64.9±0.5 10-24cm3
Surface Tension: 34.1±3.0 dyne/cm
Molar Volume: 568.1±3.0 cm3

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