ChemSpider 2D Image | (4S)-5-Hydroxy-4,8,8-trimethyl-9,10-dihydro-2H,4H-pyrano[4,3-f]chromene-2,6(8H)-dione | C15H16O5

(4S)-5-Hydroxy-4,8,8-trimethyl-9,10-dihydro-2H,4H-pyrano[4,3-f]chromene-2,6(8H)-dione

  • Molecular FormulaC15H16O5
  • Average mass276.284 Da
  • Monoisotopic mass276.099762 Da
  • ChemSpider ID34983769

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(4S)-5-Hydroxy-4,8,8-trimethyl-9,10-dihydro-2H,4H-pyrano[4,3-f]chromen-2,6(8H)-dion [German] [ACD/IUPAC Name]
(4S)-5-Hydroxy-4,8,8-trimethyl-9,10-dihydro-2H,4H-pyrano[4,3-f]chromene-2,6(8H)-dione [ACD/IUPAC Name]
(4S)-5-Hydroxy-4,8,8-triméthyl-9,10-dihydro-2H,4H-pyrano[4,3-f]chromène-2,6(8H)-dione [French] [ACD/IUPAC Name]
2H,4H-Benzo[1,2-b:4,3-c']dipyran-2,6(8H)-dione, 9,10-dihydro-5-hydroxy-4,8,8-trimethyl-, (4S)- [ACD/Index Name]
83-85-2 [RN]
Fuscin
UNII-0J373729M0

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

Density: 1.4±0.1 g/cm3
Boiling Point: 511.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 90.0±6.0 kJ/mol
Flash Point: 195.5±23.6 °C
Index of Refraction: 1.595
Molar Refractivity: 69.2±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 0.72
ACD/LogD (pH 5.5): 0.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 14.24
ACD/LogD (pH 7.4): -1.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 73 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 52.6±5.0 dyne/cm
Molar Volume: 203.8±5.0 cm3

Click to predict properties on the Chemicalize site


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