ChemSpider 2D Image | 5,6,7-Trihydroxy-8,8-dimethyl-3,10-bis(2-methyl-3-buten-2-yl)-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-2-one | C24H30O6

5,6,7-Trihydroxy-8,8-dimethyl-3,10-bis(2-methyl-3-buten-2-yl)-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-2-one

  • Molecular FormulaC24H30O6
  • Average mass414.491 Da
  • Monoisotopic mass414.204254 Da
  • ChemSpider ID35015175

More details:

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

2H,6H-Benzo[1,2-b:5,4-b']dipyran-2-one, 3,10-bis(1,1-dimethyl-2-propen-1-yl)-7,8-dihydro-5,6,7-trihydroxy-8,8-dimethyl- [ACD/Index Name]
5,6,7-Trihydroxy-8,8-dimethyl-3,10-bis(2-methyl-3-buten-2-yl)-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-2-on [German] [ACD/IUPAC Name]
5,6,7-Trihydroxy-8,8-dimethyl-3,10-bis(2-methyl-3-buten-2-yl)-7,8-dihydro-2H,6H-pyrano[3,2-g]chromen-2-one [ACD/IUPAC Name]
5,6,7-Trihydroxy-8,8-diméthyl-3,10-bis(2-méthyl-3-butén-2-yl)-7,8-dihydro-2H,6H-pyrano[3,2-g]chromén-2-one [French] [ACD/IUPAC Name]
5,6,7-trihydroxy-8,8-dimethyl-3,10-bis(2-methylbut-3-en-2-yl)-2H,6H,7H,8H-pyrano[3,2-g]chromen-2-one
5,6,7-trihydroxy-8,8-dimethyl-3,10-bis(2-methylbut-3-en-2-yl)-6H,7H-pyrano[3,2-g]chromen-2-one
Clausarinol

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: 1.2±0.1 g/cm3
Boiling Point: 508.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.0±3.0 kJ/mol
Flash Point: 166.0±23.6 °C
Index of Refraction: 1.581
Molar Refractivity: 113.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 5.32
ACD/LogD (pH 5.5): 4.80
ACD/BCF (pH 5.5): 2607.61
ACD/KOC (pH 5.5): 9661.23
ACD/LogD (pH 7.4): 4.46
ACD/BCF (pH 7.4): 1183.47
ACD/KOC (pH 7.4): 4384.79
Polar Surface Area: 96 Å2
Polarizability: 44.9±0.5 10-24cm3
Surface Tension: 49.3±3.0 dyne/cm
Molar Volume: 339.9±3.0 cm3

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