ChemSpider 2D Image | (2S,3Z,6S,10R,11Z,14S)-2,10,14-Tris(benzyloxy)-15-methyl-3,11-hexadecadien-6-ol | C38H50O4

(2S,3Z,6S,10R,11Z,14S)-2,10,14-Tris(benzyloxy)-15-methyl-3,11-hexadecadien-6-ol

  • Molecular FormulaC38H50O4
  • Average mass570.801 Da
  • Monoisotopic mass570.370911 Da
  • ChemSpider ID9116032

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2S,3Z,6S,10R,11Z,14S)-2,10,14-Tris(benzyloxy)-15-methyl-3,11-hexadecadien-6-ol [ACD/IUPAC Name]
(2S,3Z,6S,10R,11Z,14S)-2,10,14-Tris(benzyloxy)-15-methyl-3,11-hexadecadien-6-ol [German] [ACD/IUPAC Name]
(2S,3Z,6S,10R,11Z,14S)-2,10,14-Tris(benzyloxy)-15-méthyl-3,11-hexadécadién-6-ol [French] [ACD/IUPAC Name]
3,11-Hexadecadien-6-ol, 15-methyl-2,10,14-tris(phenylmethoxy)-, (2S,3Z,6S,10R,11Z,14S)- [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: 661.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.3±3.0 kJ/mol
Flash Point: 354.0±31.5 °C
Index of Refraction: 1.553
Molar Refractivity: 174.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 2
ACD/LogP: 8.87
ACD/LogD (pH 5.5): 8.49
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 991801.31
ACD/LogD (pH 7.4): 8.49
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 991801.31
Polar Surface Area: 48 Å2
Polarizability: 69.3±0.5 10-24cm3
Surface Tension: 40.8±3.0 dyne/cm
Molar Volume: 546.5±3.0 cm3

Click to predict properties on the Chemicalize site


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