ChemSpider 2D Image | (5S)-5-[(5S)-3,3-Dimethyl-5-(2-oxopropyl)-1-cyclopenten-1-yl]-5-methyldihydro-2(3H)-furanone | C15H22O3

(5S)-5-[(5S)-3,3-Dimethyl-5-(2-oxopropyl)-1-cyclopenten-1-yl]-5-methyldihydro-2(3H)-furanone

  • Molecular FormulaC15H22O3
  • Average mass250.333 Da
  • Monoisotopic mass250.156891 Da
  • ChemSpider ID30819411

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(5S)-5-[(5S)-3,3-Dimethyl-5-(2-oxopropyl)-1-cyclopenten-1-yl]-5-methyldihydro-2(3H)-furanon [German] [ACD/IUPAC Name]
(5S)-5-[(5S)-3,3-Dimethyl-5-(2-oxopropyl)-1-cyclopenten-1-yl]-5-methyldihydro-2(3H)-furanone [ACD/IUPAC Name]
(5S)-5-[(5S)-3,3-Diméthyl-5-(2-oxopropyl)-1-cyclopentén-1-yl]-5-méthyldihydro-2(3H)-furanone [French] [ACD/IUPAC Name]
2(3H)-Furanone, 5-[(5S)-3,3-dimethyl-5-(2-oxopropyl)-1-cyclopenten-1-yl]dihydro-5-methyl-, (5S)- [ACD/Index Name]
capillosanane R

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

Density: 1.1±0.1 g/cm3
Boiling Point: 374.9±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 62.2±3.0 kJ/mol
Flash Point: 164.3±26.0 °C
Index of Refraction: 1.490
Molar Refractivity: 68.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.95
ACD/LogD (pH 5.5): 2.44
ACD/BCF (pH 5.5): 42.40
ACD/KOC (pH 5.5): 508.71
ACD/LogD (pH 7.4): 2.44
ACD/BCF (pH 7.4): 42.40
ACD/KOC (pH 7.4): 508.71
Polar Surface Area: 43 Å2
Polarizability: 27.3±0.5 10-24cm3
Surface Tension: 34.6±3.0 dyne/cm
Molar Volume: 237.9±3.0 cm3

Click to predict properties on the Chemicalize site


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