ChemSpider 2D Image | 1a-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-7a-methyl-1a,7a-dihydronaphtho[2,3-b]oxirene-2,7-dione | C21H24O3

1a-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-7a-methyl-1a,7a-dihydronaphtho[2,3-b]oxirene-2,7-dione

  • Molecular FormulaC21H24O3
  • Average mass324.414 Da
  • Monoisotopic mass324.172546 Da
  • ChemSpider ID30790799

  • Double-bond stereo - Double-bond stereo

More details:

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

1a-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-7a-methyl-1a,7a-dihydronaphtho[2,3-b]oxiren-2,7-dion [German] [ACD/IUPAC Name]
1a-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-7a-methyl-1a,7a-dihydronaphtho[2,3-b]oxirene-2,7-dione [ACD/IUPAC Name]
1a-[(2E)-3,7-Diméthyl-2,6-octadién-1-yl]-7a-méthyl-1a,7a-dihydronaphto[2,3-b]oxirène-2,7-dione [French] [ACD/IUPAC Name]
Naphth[2,3-b]oxirene-2,7-dione, 1a-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-1a,7a-dihydro-7a-methyl- [ACD/Index Name]
1a-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-7a-methyl-1aH,2H,7H,7aH-naphtho[2,3-b]oxirene-2,7-dione
1a-[(2E)-3,7-dimethylocta-2,6-dien-1-yl]-7a-methylnaphtho[2,3-b]oxirene-2,7-dione
2,3-Epoxymenaquinone
C20265
Vitamin K2 2,3-epoxide

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

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

Density: 1.1±0.1 g/cm3
Boiling Point: 457.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.8±3.0 kJ/mol
Flash Point: 199.5±28.8 °C
Index of Refraction: 1.571
Molar Refractivity: 93.7±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.95
ACD/LogD (pH 5.5): 5.27
ACD/BCF (pH 5.5): 5921.77
ACD/KOC (pH 5.5): 17454.72
ACD/LogD (pH 7.4): 5.27
ACD/BCF (pH 7.4): 5921.77
ACD/KOC (pH 7.4): 17454.72
Polar Surface Area: 47 Å2
Polarizability: 37.1±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 285.0±3.0 cm3

Click to predict properties on the Chemicalize site


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