Found 1 result

Search term: 113369097 (Found by CSID)
ChemSpider 2D Image | (2E,4E,8R,9E,11E,15R)-8,10,15-Trimethyl-2,4,9,11-heptadecatetraenoic acid | C20H32O2

(2E,4E,8R,9E,11E,15R)-8,10,15-Trimethyl-2,4,9,11-heptadecatetraenoic acid

  • Molecular FormulaC20H32O2
  • Average mass304.467 Da
  • Monoisotopic mass304.240234 Da
  • ChemSpider ID113369097

  • 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,8R,9E,11E,15R)-8,10,15-Trimethyl-2,4,9,11-heptadecatetraenoic acid [ACD/IUPAC Name]
(2E,4E,8R,9E,11E,15R)-8,10,15-Trimethyl-2,4,9,11-heptadecatetraensäure [German] [ACD/IUPAC Name]
2,4,9,11-Heptadecatetraenoic acid, 8,10,15-trimethyl-, (2E,4E,8R,9E,11E,15R)- [ACD/Index Name]
Acide (2E,4E,8R,9E,11E,15R)-8,10,15-triméthyl-2,4,9,11-heptadécatétraénoïque [French] [ACD/IUPAC Name]
17:4(2E,4E,9E,11E)(8Me[R],10Me,15Me[R])
8R,10,15R-trimethyl-2E,4E,9E,11E-heptadecatetraenoic 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: 453.2±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 78.1±6.0 kJ/mol
Flash Point: 342.6±13.8 °C
Index of Refraction: 1.498
Molar Refractivity: 96.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 7.54
ACD/LogD (pH 5.5): 5.53
ACD/BCF (pH 5.5): 5397.54
ACD/KOC (pH 5.5): 8550.59
ACD/LogD (pH 7.4): 3.72
ACD/BCF (pH 7.4): 84.82
ACD/KOC (pH 7.4): 134.37
Polar Surface Area: 37 Å2
Polarizability: 38.2±0.5 10-24cm3
Surface Tension: 33.4±3.0 dyne/cm
Molar Volume: 328.3±3.0 cm3

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