ChemSpider 2D Image | (4R,5R)-4-Hydroxy-5-(methoxymethyl)-2,3-dimethyl-4-pentyl-2-cyclopenten-1-one | C14H24O3

(4R,5R)-4-Hydroxy-5-(methoxymethyl)-2,3-dimethyl-4-pentyl-2-cyclopenten-1-one

  • Molecular FormulaC14H24O3
  • Average mass240.339 Da
  • Monoisotopic mass240.172546 Da
  • ChemSpider ID35516817

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4R,5R)-4-Hydroxy-5-(methoxymethyl)-2,3-dimethyl-4-pentyl-2-cyclopenten-1-on [German] [ACD/IUPAC Name]
(4R,5R)-4-Hydroxy-5-(methoxymethyl)-2,3-dimethyl-4-pentyl-2-cyclopenten-1-one [ACD/IUPAC Name]
(4R,5R)-4-Hydroxy-5-(méthoxyméthyl)-2,3-diméthyl-4-pentyl-2-cyclopentén-1-one [French] [ACD/IUPAC Name]
2-Cyclopenten-1-one, 4-hydroxy-5-(methoxymethyl)-2,3-dimethyl-4-pentyl-, (4R,5R)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 347.7±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 68.6±6.0 kJ/mol
Flash Point: 121.5±21.4 °C
Index of Refraction: 1.476
Molar Refractivity: 68.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.32
ACD/LogD (pH 5.5): 2.79
ACD/BCF (pH 5.5): 77.33
ACD/KOC (pH 5.5): 782.12
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 77.32
ACD/KOC (pH 7.4): 782.12
Polar Surface Area: 47 Å2
Polarizability: 27.0±0.5 10-24cm3
Surface Tension: 33.2±3.0 dyne/cm
Molar Volume: 240.9±3.0 cm3

Click to predict properties on the Chemicalize site


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