ChemSpider 2D Image | 5-Methyl-3-{2,6,8,10,13-pentahydroxy-13-[5-(1-hydroxytridecyl)tetrahydro-2-furanyl]tridecyl}-2(5H)-furanone | C35H64O9

5-Methyl-3-{2,6,8,10,13-pentahydroxy-13-[5-(1-hydroxytridecyl)tetrahydro-2-furanyl]tridecyl}-2(5H)-furanone

  • Molecular FormulaC35H64O9
  • Average mass628.877 Da
  • Monoisotopic mass628.455017 Da
  • ChemSpider ID8230306

More details:

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

(+)-5-Methyl-3-[2,6,8,10,13-pentahydroxy-13-[tetrahydro-5-(1-hydroxytridecyl)-2-furanyl]tridecyl]-2(5H)-furanone
167696-97-1 [RN]
2(5H)-Furanone, 5-methyl-3-[2,6,8,10,13-pentahydroxy-13-[tetrahydro-5-(1-hydroxytridecyl)-2-furanyl]tridecyl]- [ACD/Index Name]
5-Methyl-3-{2,6,8,10,13-pentahydroxy-13-[5-(1-hydroxytridecyl)tetrahydro-2-furanyl]tridecyl}-2(5H)-furanon [German] [ACD/IUPAC Name]
5-Methyl-3-{2,6,8,10,13-pentahydroxy-13-[5-(1-hydroxytridecyl)tetrahydro-2-furanyl]tridecyl}-2(5H)-furanone [ACD/IUPAC Name]
5-Méthyl-3-{2,6,8,10,13-pentahydroxy-13-[5-(1-hydroxytridécyl)tétrahydro-2-furanyl]tridécyl}-2(5H)-furanone [French] [ACD/IUPAC Name]
5-methyl-3-{2,6,8,10,13-pentahydroxy-13-[5-(1-hydroxytridecyl)oxolan-2-yl]tridecyl}-2,5-dihydrofuran-2-one
5-methyl-3-{2,6,8,10,13-pentahydroxy-13-[5-(1-hydroxytridecyl)oxolan-2-yl]tridecyl}-5H-furan-2-one
5-Methyl-3-{2,6,8,10,13-pentahydroxy-13-[5-(1-hydroxy-tridecyl)-tetrahydro-furan-2-yl]-tridecyl}-5H-furan-2-one
Annohexocin

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

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

Density: 1.1±0.1 g/cm3
Boiling Point: 819.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 135.5±6.0 kJ/mol
Flash Point: 247.5±27.8 °C
Index of Refraction: 1.522
Molar Refractivity: 172.0±0.3 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 26
#Rule of 5 Violations: 2
ACD/LogP: 3.20
ACD/LogD (pH 5.5): 4.77
ACD/BCF (pH 5.5): 2474.47
ACD/KOC (pH 5.5): 9346.52
ACD/LogD (pH 7.4): 4.77
ACD/BCF (pH 7.4): 2474.47
ACD/KOC (pH 7.4): 9346.52
Polar Surface Area: 157 Å2
Polarizability: 68.2±0.5 10-24cm3
Surface Tension: 48.2±3.0 dyne/cm
Molar Volume: 564.2±3.0 cm3

Click to predict properties on the Chemicalize site


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