ChemSpider 2D Image | (8aS,9aR)-7,8,8a,9a-Tetrahydrochryseno[3,4-b]oxirene | C18H14O

(8aS,9aR)-7,8,8a,9a-Tetrahydrochryseno[3,4-b]oxirene

  • Molecular FormulaC18H14O
  • Average mass246.303 Da
  • Monoisotopic mass246.104462 Da
  • ChemSpider ID21782166

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(+)-1,2,3,4-Tetrahydro-3,4-epoxychrysene
(8aS,9aR)-7,8,8a,9a-Tetrahydrochryseno[3,4-b]oxiren [German] [ACD/IUPAC Name]
(8aS,9aR)-7,8,8a,9a-Tetrahydrochryseno[3,4-b]oxirene [ACD/IUPAC Name]
(8aS,9aR)-7,8,8a,9a-Tétrahydrochryséno[3,4-b]oxirène [French] [ACD/IUPAC Name]
Chryseno[3,4-b]oxirene, 7,8,8a,9a-tetrahydro-, (8aS,9aR)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 460.3±14.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.3±3.0 kJ/mol
Flash Point: 219.2±16.3 °C
Index of Refraction: 1.740
Molar Refractivity: 78.4±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 4.47
ACD/LogD (pH 5.5): 4.54
ACD/BCF (pH 5.5): 1654.50
ACD/KOC (pH 5.5): 7006.80
ACD/LogD (pH 7.4): 4.54
ACD/BCF (pH 7.4): 1654.50
ACD/KOC (pH 7.4): 7006.80
Polar Surface Area: 13 Å2
Polarizability: 31.1±0.5 10-24cm3
Surface Tension: 57.3±3.0 dyne/cm
Molar Volume: 194.3±3.0 cm3

Click to predict properties on the Chemicalize site


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