ChemSpider 2D Image | (4R,5R)-5-Allyl-4-hydroxy-3-propyl-2-cyclopenten-1-one | C11H16O2

(4R,5R)-5-Allyl-4-hydroxy-3-propyl-2-cyclopenten-1-one

  • Molecular FormulaC11H16O2
  • Average mass180.243 Da
  • Monoisotopic mass180.115036 Da
  • ChemSpider ID40256845

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(4R,5R)-5-Allyl-4-hydroxy-3-propyl-2-cyclopenten-1-on [German] [ACD/IUPAC Name]
(4R,5R)-5-Allyl-4-hydroxy-3-propyl-2-cyclopenten-1-one [ACD/IUPAC Name]
(4R,5R)-5-Allyl-4-hydroxy-3-propyl-2-cyclopentén-1-one [French] [ACD/IUPAC Name]
2-Cyclopenten-1-one, 4-hydroxy-5-(2-propen-1-yl)-3-propyl-, (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: 301.2±41.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 62.8±6.0 kJ/mol
Flash Point: 127.1±20.2 °C
Index of Refraction: 1.500
Molar Refractivity: 52.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.35
ACD/LogD (pH 5.5): 1.19
ACD/BCF (pH 5.5): 4.70
ACD/KOC (pH 5.5): 105.41
ACD/LogD (pH 7.4): 1.19
ACD/BCF (pH 7.4): 4.70
ACD/KOC (pH 7.4): 105.41
Polar Surface Area: 37 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 35.8±3.0 dyne/cm
Molar Volume: 176.7±3.0 cm3

Click to predict properties on the Chemicalize site


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