ChemSpider 2D Image | Retinyl hexadecanoate | C36H58O3

Retinyl hexadecanoate

  • Molecular FormulaC36H58O3
  • Average mass538.844 Da
  • Monoisotopic mass538.438599 Da
  • ChemSpider ID10618934
  • Double-bond stereo - Double-bond stereo


More details:






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

O15-hexadecanoylretinoic acid
O15-Palmitoylretinoic acid [ACD/IUPAC Name]
O15-Palmitoylrétinoïque acide [French] [ACD/IUPAC Name]
O15-hexadecanoylretinoic acid
Retinyl hexadecanoate
TRANS-RETINYL PALMITATE
[(2E,4E,6E,8E)-3,7-dimethyl-9-(2,6,6-trimethyl-1-cyclohexenyl)nona-2,4,6,8-tetraenyl] hexadecanoate
201-228-5 [EINECS]
79-81-2 [RN]
Retinyl palmitate

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

Density: 0.9±0.1 g/cm3
Boiling Point: 643.5±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.9±3.0 kJ/mol
Flash Point: 300.2±19.5 °C
Index of Refraction: 1.511
Molar Refractivity: 169.9±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 21
#Rule of 5 Violations: 2
ACD/LogP: 14.11
ACD/LogD (pH 5.5): 12.89
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 12.89
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 43 Å2
Polarizability: 67.4±0.5 10-24cm3
Surface Tension: 36.4±3.0 dyne/cm
Molar Volume: 567.2±3.0 cm3

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