ChemSpider 2D Image | (5R)-4-Methyl-5-[(3R,7R)-3,7,11-trimethyldodecyl]-2(5H)-furanone | C20H36O2

(5R)-4-Methyl-5-[(3R,7R)-3,7,11-trimethyldodecyl]-2(5H)-furanone

  • Molecular FormulaC20H36O2
  • Average mass308.499 Da
  • Monoisotopic mass308.271515 Da
  • ChemSpider ID35516612

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(5R)-4-Methyl-5-[(3R,7R)-3,7,11-trimethyldodecyl]-2(5H)-furanon [German] [ACD/IUPAC Name]
(5R)-4-Methyl-5-[(3R,7R)-3,7,11-trimethyldodecyl]-2(5H)-furanone [ACD/IUPAC Name]
(5R)-4-Méthyl-5-[(3R,7R)-3,7,11-triméthyldodécyl]-2(5H)-furanone [French] [ACD/IUPAC Name]
2(5H)-Furanone, 4-methyl-5-[(3R,7R)-3,7,11-trimethyldodecyl]-, (5R)- [ACD/Index Name]

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

Density: 0.9±0.1 g/cm3
Boiling Point: 416.5±14.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.0±3.0 kJ/mol
Flash Point: 175.9±17.5 °C
Index of Refraction: 1.463
Molar Refractivity: 93.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 7.13
ACD/LogD (pH 5.5): 6.23
ACD/BCF (pH 5.5): 32008.81
ACD/KOC (pH 5.5): 58405.82
ACD/LogD (pH 7.4): 6.23
ACD/BCF (pH 7.4): 32008.81
ACD/KOC (pH 7.4): 58405.82
Polar Surface Area: 26 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 30.8±3.0 dyne/cm
Molar Volume: 340.8±3.0 cm3

Click to predict properties on the Chemicalize site


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