ChemSpider 2D Image | 5-{11-Hydroxy-11-[5'-(1-hydroxyundecyl)octahydro-2,2'-bifuran-5-yl]undecyl}-3-(2-oxopropyl)dihydro-2(3H)-furanone | C37H66O7

5-{11-Hydroxy-11-[5'-(1-hydroxyundecyl)octahydro-2,2'-bifuran-5-yl]undecyl}-3-(2-oxopropyl)dihydro-2(3H)-furanone

  • Molecular FormulaC37H66O7
  • Average mass622.916 Da
  • Monoisotopic mass622.480835 Da
  • ChemSpider ID115303

More details:

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

2(3H)-Furanone, dihydro-5-[11-hydroxy-11-[octahydro-5'-(1-hydroxyundecyl)[2,2'-bifuran]-5-yl]undecyl]-3-(2-oxopropyl)- [ACD/Index Name]
5-{11-Hydroxy-11-[5'-(1-hydroxyundecyl)octahydro-2,2'-bifuran-5-yl]undecyl}-3-(2-oxopropyl)dihydro-2(3H)-furanon [German] [ACD/IUPAC Name]
5-{11-Hydroxy-11-[5'-(1-hydroxyundecyl)octahydro-2,2'-bifuran-5-yl]undecyl}-3-(2-oxopropyl)dihydro-2(3H)-furanone [ACD/IUPAC Name]
5-{11-Hydroxy-11-[5'-(1-hydroxyundécyl)octahydro-2,2'-bifuran-5-yl]undécyl}-3-(2-oxopropyl)dihydro-2(3H)-furanone [French] [ACD/IUPAC Name]
(3s,5r)-5-[(11r)-11-hydroxy-11-{(2r,2'r,5'r)-5'-[(1s)-1-hydroxyundecyl]octahydro-2,2'-bifuran-5-yl}undecyl]-3-(2-oxopropyl)dihydrofuran-2(3h)-one
123012-00-0 [RN]
2,4-cis-Trilobacinone
5-(11-hydroxy-11-{5-[5-(1-hydroxyundecyl)oxolan-2-yl]oxolan-2-yl}undecyl)-3-(2-oxopropyl)oxolan-2-one
5-[11-Hydroxy-11-[5-[5-(1-hydroxyundecyl)oxolan-2-yl]oxolan-2-yl]undecyl]-3-(2-oxopropyl)oxolan-2-one
5-{11-HYDROXY-11-[5'-(1-HYDROXYUNDECYL)-[2,2'-BIOXOLANE]-5-YL]UNDECYL}-3-(2-OXOPROPYL)OXOLAN-2-ONE
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

C08470 [DBID]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 738.3±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.5 mmHg at 25°C
Enthalpy of Vaporization: 122.9±6.0 kJ/mol
Flash Point: 217.7±18.1 °C
Index of Refraction: 1.496
Molar Refractivity: 175.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 25
#Rule of 5 Violations: 2
ACD/LogP: 7.45
ACD/LogD (pH 5.5): 7.70
ACD/BCF (pH 5.5): 418940.03
ACD/KOC (pH 5.5): 368051.78
ACD/LogD (pH 7.4): 7.70
ACD/BCF (pH 7.4): 418940.03
ACD/KOC (pH 7.4): 368051.78
Polar Surface Area: 102 Å2
Polarizability: 69.5±0.5 10-24cm3
Surface Tension: 40.4±3.0 dyne/cm
Molar Volume: 600.0±3.0 cm3

Click to predict properties on the Chemicalize site


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