ChemSpider 2D Image | Granuloside | C26H38O3

Granuloside

  • Molecular FormulaC26H38O3
  • Average mass398.578 Da
  • Monoisotopic mass398.282104 Da
  • ChemSpider ID35000233

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(5R)-3-Ethyl-5-[(1E,5E,8E,10E)-6-ethyl-2,10,14-trimethyl-1,5,8,10,13-pentadecapentaen-1-yl]-4-hydroxy-2(5H)-furanon [German] [ACD/IUPAC Name]
(5R)-3-Ethyl-5-[(1E,5E,8E,10E)-6-ethyl-2,10,14-trimethyl-1,5,8,10,13-pentadecapentaen-1-yl]-4-hydroxy-2(5H)-furanone [ACD/IUPAC Name]
(5R)-3-Éthyl-5-[(1E,5E,8E,10E)-6-éthyl-2,10,14-triméthyl-1,5,8,10,13-pentadécapentaén-1-yl]-4-hydroxy-2(5H)-furanone [French] [ACD/IUPAC Name]
2(5H)-Furanone, 3-ethyl-5-[(1E,5E,8E,10E)-6-ethyl-2,10,14-trimethyl-1,5,8,10,13-pentadecapentaen-1-yl]-4-hydroxy-, (5R)- [ACD/Index Name]
Granuloside

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

Density: 1.0±0.1 g/cm3
Boiling Point: 546.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.3 mmHg at 25°C
Enthalpy of Vaporization: 94.9±6.0 kJ/mol
Flash Point: 208.5±22.9 °C
Index of Refraction: 1.553
Molar Refractivity: 124.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 8.06
ACD/LogD (pH 5.5): 5.58
ACD/BCF (pH 5.5): 4602.92
ACD/KOC (pH 5.5): 5643.48
ACD/LogD (pH 7.4): 3.92
ACD/BCF (pH 7.4): 100.50
ACD/KOC (pH 7.4): 123.22
Polar Surface Area: 47 Å2
Polarizability: 49.5±0.5 10-24cm3
Surface Tension: 40.7±3.0 dyne/cm
Molar Volume: 390.3±3.0 cm3

Click to predict properties on the Chemicalize site


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