ChemSpider 2D Image | 3-{13-Hydroxy-13-[5-(1-hydroxytridecyl)tetrahydro-2-furanyl]tridecyl}-5-methyl-2(5H)-furanone | C35H64O5

3-{13-Hydroxy-13-[5-(1-hydroxytridecyl)tetrahydro-2-furanyl]tridecyl}-5-methyl-2(5H)-furanone

  • Molecular FormulaC35H64O5
  • Average mass564.880 Da
  • Monoisotopic mass564.475403 Da
  • ChemSpider ID8274978

More details:

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

2(5H)-Furanone, 3-[13-hydroxy-13-[tetrahydro-5-(1-hydroxytridecyl)-2-furanyl]tridecyl]-5-methyl- [ACD/Index Name]
3-{13-Hydroxy-13-[5-(1-hydroxytridecyl)tetrahydro-2-furanyl]tridecyl}-5-methyl-2(5H)-furanon [German] [ACD/IUPAC Name]
3-{13-Hydroxy-13-[5-(1-hydroxytridecyl)tetrahydro-2-furanyl]tridecyl}-5-methyl-2(5H)-furanone [ACD/IUPAC Name]
3-{13-Hydroxy-13-[5-(1-hydroxytridécyl)tétrahydro-2-furanyl]tridécyl}-5-méthyl-2(5H)-furanone [French] [ACD/IUPAC Name]
3-{13-hydroxy-13-[5-(1-hydroxytridecyl)oxolan-2-yl]tridecyl}-5-methyl-5H-furan-2-one
cis-solamin

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

Density: 1.0±0.1 g/cm3
Boiling Point: 683.2±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±4.8 mmHg at 25°C
Enthalpy of Vaporization: 114.6±6.0 kJ/mol
Flash Point: 202.0±16.7 °C
Index of Refraction: 1.492
Molar Refractivity: 166.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 26
#Rule of 5 Violations: 2
ACD/LogP: 10.24
ACD/LogD (pH 5.5): 9.93
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 6025678.00
ACD/LogD (pH 7.4): 9.93
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 6025678.00
Polar Surface Area: 76 Å2
Polarizability: 65.8±0.5 10-24cm3
Surface Tension: 38.5±3.0 dyne/cm
Molar Volume: 572.7±3.0 cm3

Click to predict properties on the Chemicalize site


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