ChemSpider 2D Image | marianin A | C20H24O4

marianin A

  • Molecular FormulaC20H24O4
  • Average mass328.402 Da
  • Monoisotopic mass328.167450 Da
  • ChemSpider ID26398701

More details:

Featured data source
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2H-1-Benzopyran-2-one, 5-methyl-4,7-bis[(3-methyl-2-buten-1-yl)oxy]- [ACD/Index Name]
5-Methyl-4,7-bis[(3-methyl-2-buten-1-yl)oxy]-2H-chromen-2-on [German] [ACD/IUPAC Name]
5-Methyl-4,7-bis[(3-methyl-2-buten-1-yl)oxy]-2H-chromen-2-one [ACD/IUPAC Name]
5-Méthyl-4,7-bis[(3-méthyl-2-butén-1-yl)oxy]-2H-chromén-2-one [French] [ACD/IUPAC Name]
marianin A

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

Density: 1.1±0.1 g/cm3
Boiling Point: 499.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.8±3.0 kJ/mol
Flash Point: 218.9±28.8 °C
Index of Refraction: 1.552
Molar Refractivity: 93.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 6.04
ACD/LogD (pH 5.5): 4.53
ACD/BCF (pH 5.5): 1626.63
ACD/KOC (pH 5.5): 6922.11
ACD/LogD (pH 7.4): 4.53
ACD/BCF (pH 7.4): 1626.63
ACD/KOC (pH 7.4): 6922.11
Polar Surface Area: 45 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 41.8±5.0 dyne/cm
Molar Volume: 294.0±5.0 cm3

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