ChemSpider 2D Image | (2R)-2-[(1R,6R)-6-Isopropenyl-3-methyl-2-oxo-3-cyclohexen-1-yl]-3,4-dihydro-1(2H)-naphthalenone | C20H22O2

(2R)-2-[(1R,6R)-6-Isopropenyl-3-methyl-2-oxo-3-cyclohexen-1-yl]-3,4-dihydro-1(2H)-naphthalenone

  • Molecular FormulaC20H22O2
  • Average mass294.388 Da
  • Monoisotopic mass294.161987 Da
  • ChemSpider ID30651535

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(2R)-2-[(1R,6R)-6-Isopropényl-3-méthyl-2-oxo-3-cyclohexén-1-yl]-3,4-dihydro-1(2H)-naphtalénone [French] [ACD/IUPAC Name]
(2R)-2-[(1R,6R)-6-Isopropenyl-3-methyl-2-oxo-3-cyclohexen-1-yl]-3,4-dihydro-1(2H)-naphthalenone [ACD/IUPAC Name]
(2R)-2-[(1R,6R)-6-Isopropenyl-3-methyl-2-oxo-3-cyclohexen-1-yl]-3,4-dihydro-1(2H)-naphthalinon [German] [ACD/IUPAC Name]
1(2H)-Naphthalenone, 3,4-dihydro-2-[(1R,6R)-3-methyl-6-(1-methylethenyl)-2-oxo-3-cyclohexen-1-yl]-, (2R)- [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: 451.1±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.0±3.0 kJ/mol
Flash Point: 168.1±25.7 °C
Index of Refraction: 1.565
Molar Refractivity: 86.7±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.63
ACD/LogD (pH 5.5): 4.61
ACD/BCF (pH 5.5): 1871.01
ACD/KOC (pH 5.5): 7651.55
ACD/LogD (pH 7.4): 4.61
ACD/BCF (pH 7.4): 1871.01
ACD/KOC (pH 7.4): 7651.55
Polar Surface Area: 34 Å2
Polarizability: 34.4±0.5 10-24cm3
Surface Tension: 41.9±3.0 dyne/cm
Molar Volume: 266.2±3.0 cm3

Click to predict properties on the Chemicalize site


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