ChemSpider 2D Image | (3R)-4,4-Dimethyl-2-oxotetrahydro-3-furanyl 3-cyclohexylbutanoate | C16H26O4

(3R)-4,4-Dimethyl-2-oxotetrahydro-3-furanyl 3-cyclohexylbutanoate

  • Molecular FormulaC16H26O4
  • Average mass282.375 Da
  • Monoisotopic mass282.183105 Da
  • ChemSpider ID31816492

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

(3R)-4,4-Dimethyl-2-oxotetrahydro-3-furanyl 3-cyclohexylbutanoate [ACD/IUPAC Name]
(3R)-4,4-Dimethyl-2-oxotetrahydro-3-furanyl-3-cyclohexylbutanoat [German] [ACD/IUPAC Name]
3-Cyclohexylbutanoate de (3R)-4,4-diméthyl-2-oxotétrahydro-3-furanyle [French] [ACD/IUPAC Name]
Cyclohexanepropanoic acid, β-methyl-, (3R)-tetrahydro-4,4-dimethyl-2-oxo-3-furanyl ester [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 395.7±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.6±3.0 kJ/mol
Flash Point: 193.1±24.4 °C
Index of Refraction: 1.487
Molar Refractivity: 75.7±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.27
ACD/LogD (pH 5.5): 3.37
ACD/BCF (pH 5.5): 215.94
ACD/KOC (pH 5.5): 1631.27
ACD/LogD (pH 7.4): 3.37
ACD/BCF (pH 7.4): 215.94
ACD/KOC (pH 7.4): 1631.27
Polar Surface Area: 53 Å2
Polarizability: 30.0±0.5 10-24cm3
Surface Tension: 37.8±5.0 dyne/cm
Molar Volume: 263.4±5.0 cm3

Click to predict properties on the Chemicalize site


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