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Search term: 78442265 (Found by CSID)
ChemSpider 2D Image | (4R,5R)-3-sec-Butyl-2,5-diethyl-4-hydroxy-5-methyl-2-cyclopenten-1-one | C14H24O2

(4R,5R)-3-sec-Butyl-2,5-diethyl-4-hydroxy-5-methyl-2-cyclopenten-1-one

  • Molecular FormulaC14H24O2
  • Average mass224.339 Da
  • Monoisotopic mass224.177628 Da
  • ChemSpider ID78442265

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

(4R,5R)-3-sec-Butyl-2,5-diethyl-4-hydroxy-5-methyl-2-cyclopenten-1-on [German] [ACD/IUPAC Name]
(4R,5R)-3-sec-Butyl-2,5-diethyl-4-hydroxy-5-methyl-2-cyclopenten-1-one [ACD/IUPAC Name]
(4R,5R)-3-sec-Butyl-2,5-diéthyl-4-hydroxy-5-méthyl-2-cyclopentén-1-one [French] [ACD/IUPAC Name]
2-Cyclopenten-1-one, 2,5-diethyl-4-hydroxy-5-methyl-3-(1-methylpropyl)-, (4R,5R)- [ACD/Index Name]
Similin C

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

Density: 1.0±0.1 g/cm3
Boiling Point: 328.8±41.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 66.2±6.0 kJ/mol
Flash Point: 139.7±20.2 °C
Index of Refraction: 1.478
Molar Refractivity: 66.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.19
ACD/LogD (pH 5.5): 3.32
ACD/BCF (pH 5.5): 197.76
ACD/KOC (pH 5.5): 1531.71
ACD/LogD (pH 7.4): 3.32
ACD/BCF (pH 7.4): 197.76
ACD/KOC (pH 7.4): 1531.71
Polar Surface Area: 37 Å2
Polarizability: 26.2±0.5 10-24cm3
Surface Tension: 32.0±3.0 dyne/cm
Molar Volume: 233.7±3.0 cm3

Click to predict properties on the Chemicalize site


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