ChemSpider 2D Image | Interfungin | C23H18O8

Interfungin

  • Molecular FormulaC23H18O8
  • Average mass422.384 Da
  • Monoisotopic mass422.100159 Da
  • ChemSpider ID23283929

  • Double-bond stereo - Double-bond stereo

More details:

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

2H-Pyran-2-one, 6-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-3-[(1Z)-1-[(3,4-dihydroxyphenyl)methylene]-2-oxopropyl]-4-hydroxy- [ACD/Index Name]
3-[(1Z)-1-(3,4-Dihydroxyphenyl)-3-oxo-1-buten-2-yl]-6-[(E)-2-(3,4-dihydroxyphenyl)vinyl]-4-hydroxy-2H-pyran-2-on [German] [ACD/IUPAC Name]
3-[(1Z)-1-(3,4-Dihydroxyphenyl)-3-oxo-1-buten-2-yl]-6-[(E)-2-(3,4-dihydroxyphenyl)vinyl]-4-hydroxy-2H-pyran-2-one [ACD/IUPAC Name]
3-[(1Z)-1-(3,4-Dihydroxyphényl)-3-oxo-1-butén-2-yl]-6-[(E)-2-(3,4-dihydroxyphényl)vinyl]-4-hydroxy-2H-pyran-2-one [French] [ACD/IUPAC Name]
6-[(E)-2-(3,4-dihydroxyphenyl)ethenyl]-3-[(1Z)-1-(3,4-dihydroxyphenyl)-3-oxobut-1-en-2-yl]-4-hydroxy-2H-pyran-2-one
Interfungin
interfungin B

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

Density: 1.6±0.1 g/cm3
Boiling Point: 717.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 110.0±3.0 kJ/mol
Flash Point: 252.5±26.4 °C
Index of Refraction: 1.838
Molar Refractivity: 114.9±0.3 cm3
#H bond acceptors: 8
#H bond donors: 5
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 1.83
ACD/LogD (pH 5.5): 1.07
ACD/BCF (pH 5.5): 2.31
ACD/KOC (pH 5.5): 34.66
ACD/LogD (pH 7.4): -0.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 145 Å2
Polarizability: 45.5±0.5 10-24cm3
Surface Tension: 105.6±3.0 dyne/cm
Molar Volume: 259.8±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement