ChemSpider 2D Image | (2Z,6E)-2-[(3E)-4,8-Dimethyl-3,7-nonadien-1-yl]-6-methyl-2,6-octadiene-1,8-diol | C20H34O2

(2Z,6E)-2-[(3E)-4,8-Dimethyl-3,7-nonadien-1-yl]-6-methyl-2,6-octadiene-1,8-diol

  • Molecular FormulaC20H34O2
  • Average mass306.483 Da
  • Monoisotopic mass306.255890 Da
  • ChemSpider ID68895555

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z,6E)-2-[(3E)-4,8-Dimethyl-3,7-nonadien-1-yl]-6-methyl-2,6-octadien-1,8-diol [German] [ACD/IUPAC Name]
(2Z,6E)-2-[(3E)-4,8-Dimethyl-3,7-nonadien-1-yl]-6-methyl-2,6-octadiene-1,8-diol [ACD/IUPAC Name]
(2Z,6E)-2-[(3E)-4,8-Diméthyl-3,7-nonadién-1-yl]-6-méthyl-2,6-octadiène-1,8-diol [French] [ACD/IUPAC Name]
2,6-Octadiene-1,8-diol, 2-[(3E)-4,8-dimethyl-3,7-nonadien-1-yl]-6-methyl-, (2Z,6E)- [ACD/Index Name]
64218-02-6 [RN]
MFCD00866883 [MDL number]
plaunotol [INN] [JAN]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 440.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 80.5±6.0 kJ/mol
Flash Point: 190.6±23.3 °C
Index of Refraction: 1.507
Molar Refractivity: 97.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 5.75
ACD/LogD (pH 5.5): 5.21
ACD/BCF (pH 5.5): 5379.23
ACD/KOC (pH 5.5): 16294.53
ACD/LogD (pH 7.4): 5.21
ACD/BCF (pH 7.4): 5379.23
ACD/KOC (pH 7.4): 16294.53
Polar Surface Area: 40 Å2
Polarizability: 38.6±0.5 10-24cm3
Surface Tension: 34.8±3.0 dyne/cm
Molar Volume: 327.3±3.0 cm3

Click to predict properties on the Chemicalize site


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