ChemSpider 2D Image | (2E,10E,13S)-1,13-Dihydroxy-3,11,15-trimethyl-7-methylene-2,10,14-hexadecatrien-6-one | C20H32O3

(2E,10E,13S)-1,13-Dihydroxy-3,11,15-trimethyl-7-methylene-2,10,14-hexadecatrien-6-one

  • Molecular FormulaC20H32O3
  • Average mass320.466 Da
  • Monoisotopic mass320.235138 Da
  • ChemSpider ID101437734

  • 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

(2E,10E,13S)-1,13-Dihydroxy-3,11,15-trimethyl-7-methylen-2,10,14-hexadecatrien-6-on [German] [ACD/IUPAC Name]
(2E,10E,13S)-1,13-Dihydroxy-3,11,15-trimethyl-7-methylene-2,10,14-hexadecatrien-6-one [ACD/IUPAC Name]
(2E,10E,13S)-1,13-Dihydroxy-3,11,15-triméthyl-7-méthylène-2,10,14-hexadécatrién-6-one [French] [ACD/IUPAC Name]
2,10,14-Hexadecatrien-6-one, 1,13-dihydroxy-3,11,15-trimethyl-7-methylene-, (2E,10E,13S)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 477.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 85.5±6.0 kJ/mol
Flash Point: 256.8±25.2 °C
Index of Refraction: 1.507
Molar Refractivity: 97.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 3.80
ACD/LogD (pH 5.5): 4.24
ACD/BCF (pH 5.5): 979.45
ACD/KOC (pH 5.5): 4814.45
ACD/LogD (pH 7.4): 4.24
ACD/BCF (pH 7.4): 979.45
ACD/KOC (pH 7.4): 4814.45
Polar Surface Area: 58 Å2
Polarizability: 38.5±0.5 10-24cm3
Surface Tension: 36.0±3.0 dyne/cm
Molar Volume: 326.3±3.0 cm3

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