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Search term: 113369094 (Found by CSID)
ChemSpider 2D Image | (2E,4E,7R,8E,10E,14R)-7,9,14-Trimethyl-2,4,8,10-hexadecatetraenoic acid | C19H30O2

(2E,4E,7R,8E,10E,14R)-7,9,14-Trimethyl-2,4,8,10-hexadecatetraenoic acid

  • Molecular FormulaC19H30O2
  • Average mass290.440 Da
  • Monoisotopic mass290.224579 Da
  • ChemSpider ID113369094

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2E,4E,7R,8E,10E,14R)-7,9,14-Trimethyl-2,4,8,10-hexadecatetraenoic acid [ACD/IUPAC Name]
(2E,4E,7R,8E,10E,14R)-7,9,14-Trimethyl-2,4,8,10-hexadecatetraensäure [German] [ACD/IUPAC Name]
2,4,8,10-Hexadecatetraenoic acid, 7,9,14-trimethyl-, (2E,4E,7R,8E,10E,14R)- [ACD/Index Name]
Acide (2E,4E,7R,8E,10E,14R)-7,9,14-triméthyl-2,4,8,10-hexadécatétraénoïque [French] [ACD/IUPAC Name]
16:4(2E,4E,8E,10E)(7Me[R],9Me,14Me[R])
7R,9,14R-trimethyl-2E,4E,8E,10E-hexadecatetraenoic acid

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

Density: 0.9±0.1 g/cm3
Boiling Point: 437.1±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 76.1±6.0 kJ/mol
Flash Point: 328.8±13.8 °C
Index of Refraction: 1.500
Molar Refractivity: 91.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 6.75
ACD/LogD (pH 5.5): 4.93
ACD/BCF (pH 5.5): 1866.22
ACD/KOC (pH 5.5): 3937.53
ACD/LogD (pH 7.4): 3.12
ACD/BCF (pH 7.4): 29.35
ACD/KOC (pH 7.4): 61.93
Polar Surface Area: 37 Å2
Polarizability: 36.3±0.5 10-24cm3
Surface Tension: 33.4±3.0 dyne/cm
Molar Volume: 311.8±3.0 cm3

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