ChemSpider 2D Image | (2E,7R,11R)-3,7,11,15-Tetramethyl-2-hexadecen-1-ol | C20H40O

(2E,7R,11R)-3,7,11,15-Tetramethyl-2-hexadecen-1-ol

  • Molecular FormulaC20H40O
  • Average mass296.531 Da
  • Monoisotopic mass296.307922 Da
  • ChemSpider ID25991984
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(2E,7R,11R)-3,7,11,15-Tetramethyl-2-hexadecen-1-ol [ACD/IUPAC Name]
(2E,7R,11R)-3,7,11,15-Tetramethyl-2-hexadecen-1-ol [German] [ACD/IUPAC Name]
(2E,7R,11R)-3,7,11,15-Tétraméthyl-2-hexadécén-1-ol [French] [ACD/IUPAC Name]
2-Hexadecen-1-ol, 3,7,11,15-tetramethyl-, (2E,7R,11R)- [ACD/Index Name]
(E)-Phytol
(E,7R,11R)-3,7,11,15-tetramethylhexadec-2-en-1-ol
(Z)-Phytol
150-86-7 [RN]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 0.8±0.1 g/cm3
Boiling Point: 335.5±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 67.0±6.0 kJ/mol
Flash Point: 157.5±8.9 °C
Index of Refraction: 1.460
Molar Refractivity: 96.0±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 8.66
ACD/LogD (pH 5.5): 7.54
ACD/BCF (pH 5.5): 315790.59
ACD/KOC (pH 5.5): 300637.78
ACD/LogD (pH 7.4): 7.54
ACD/BCF (pH 7.4): 315790.59
ACD/KOC (pH 7.4): 300637.78
Polar Surface Area: 20 Å2
Polarizability: 38.1±0.5 10-24cm3
Surface Tension: 29.9±3.0 dyne/cm
Molar Volume: 350.7±3.0 cm3

Click to predict properties on the Chemicalize site






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