Found 13 results

Search term: MF = 'C_{35}H_{66}O_{4}'
ChemSpider 2D Image | (2S,3S,5R)-5-[(1R)-1-Hydroxy-9-decen-1-yl]-2-pentyltetrahydro-3-furanyl palmitate | C35H66O4

(2S,3S,5R)-5-[(1R)-1-Hydroxy-9-decen-1-yl]-2-pentyltetrahydro-3-furanyl palmitate

  • Molecular FormulaC35H66O4
  • Average mass550.896 Da
  • Monoisotopic mass550.496094 Da
  • ChemSpider ID10224462

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

(2S,3S,5R)-5-[(1R)-1-Hydroxy-9-decen-1-yl]-2-pentyltetrahydro-3-furanyl palmitate [ACD/IUPAC Name]
(2S,3S,5R)-5-[(1R)-1-Hydroxy-9-decen-1-yl]-2-pentyltetrahydro-3-furanylpalmitat [German] [ACD/IUPAC Name]
Hexadecanoic acid, (2S,3S,5R)-tetrahydro-5-[(1R)-1-hydroxy-9-decen-1-yl]-2-pentyl-3-furanyl ester [ACD/Index Name]
Palmitate de (2S,3S,5R)-5-[(1R)-1-hydroxy-9-décén-1-yl]-2-pentyltétrahydro-3-furanyle [French] [ACD/IUPAC Name]
6,9-epoxynonadecene-diol 7-hexadecanoate

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

Density: 0.9±0.1 g/cm3
Boiling Point: 617.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.1 mmHg at 25°C
Enthalpy of Vaporization: 105.1±6.0 kJ/mol
Flash Point: 176.2±22.2 °C
Index of Refraction: 1.483
Molar Refractivity: 166.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 29
#Rule of 5 Violations: 2
ACD/LogP: 13.55
ACD/LogD (pH 5.5): 12.87
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 12.87
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 56 Å2
Polarizability: 66.2±0.5 10-24cm3
Surface Tension: 37.4±5.0 dyne/cm
Molar Volume: 584.8±5.0 cm3

Click to predict properties on the Chemicalize site


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