ChemSpider 2D Image | (6aR,11aS)-9-Methoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromen-3-ol | C16H14O4

(6aR,11aS)-9-Methoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromen-3-ol

  • Molecular FormulaC16H14O4
  • Average mass270.280 Da
  • Monoisotopic mass270.089203 Da
  • ChemSpider ID113611440

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(6aR,11aS)-9-Methoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromen-3-ol [German] [ACD/IUPAC Name]
(6aR,11aS)-9-Methoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromen-3-ol [ACD/IUPAC Name]
(6aR,11aS)-9-Méthoxy-6a,11a-dihydro-6H-[1]benzofuro[3,2-c]chromén-3-ol [French] [ACD/IUPAC Name]
6H-Benzofuro[3,2-c][1]benzopyran-3-ol, 6a,11a-dihydro-9-methoxy-, (6aR,11aS)- [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: 418.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.8±3.0 kJ/mol
Flash Point: 207.1±28.7 °C
Index of Refraction: 1.630
Molar Refractivity: 72.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.72
ACD/LogD (pH 5.5): 3.08
ACD/BCF (pH 5.5): 128.85
ACD/KOC (pH 5.5): 1127.17
ACD/LogD (pH 7.4): 3.08
ACD/BCF (pH 7.4): 127.85
ACD/KOC (pH 7.4): 1118.46
Polar Surface Area: 48 Å2
Polarizability: 28.9±0.5 10-24cm3
Surface Tension: 54.5±3.0 dyne/cm
Molar Volume: 204.8±3.0 cm3

Click to predict properties on the Chemicalize site


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