ChemSpider 2D Image | O~15~-[(5Z,8Z,11Z)-5,8,11-Icosatrienoyl]retinol | C40H62O2

O15-[(5Z,8Z,11Z)-5,8,11-Icosatrienoyl]retinol

  • Molecular FormulaC40H62O2
  • Average mass574.919 Da
  • Monoisotopic mass574.474976 Da
  • ChemSpider ID9774267

  • Double-bond stereo - Double-bond stereo

More details:

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

O15-[(5Z,8Z,11Z)-5,8,11-Icosatrienoyl]retinol [ACD/IUPAC Name]
O15-[(5Z,8Z,11Z)-5,8,11-Icosatrienoyl]retinol [German] [ACD/IUPAC Name]
O15-[(5Z,8Z,11Z)-5,8,11-Icosatrienoyl]rétinol [French] [ACD/IUPAC Name]
Retinol, O15-[(5Z,8Z,11Z)-1-oxo-5,8,11-eicosatrien-1-yl]- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 650.9±44.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.9±3.0 kJ/mol
Flash Point: 72.1±26.8 °C
Index of Refraction: 1.523
Molar Refractivity: 188.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 22
#Rule of 5 Violations: 2
ACD/LogP: 15.36
ACD/LogD (pH 5.5): 13.99
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 13.99
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 26 Å2
Polarizability: 74.8±0.5 10-24cm3
Surface Tension: 36.0±3.0 dyne/cm
Molar Volume: 617.0±3.0 cm3

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