ChemSpider 2D Image | (4E)-1,7-Bis(3,4-dihydroxyphenyl)-4-hepten-3-one | C19H20O5

(4E)-1,7-Bis(3,4-dihydroxyphenyl)-4-hepten-3-one

  • Molecular FormulaC19H20O5
  • Average mass328.359 Da
  • Monoisotopic mass328.131073 Da
  • ChemSpider ID72381617

More details:

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

(4E)-1,7-Bis(3,4-dihydroxyphenyl)-4-hepten-3-on [German] [ACD/IUPAC Name]
(4E)-1,7-Bis(3,4-dihydroxyphenyl)-4-hepten-3-one [ACD/IUPAC Name]
(4E)-1,7-Bis(3,4-dihydroxyphényl)-4-heptén-3-one [French] [ACD/IUPAC Name]
4-Hepten-3-one, 1,7-bis(3,4-dihydroxyphenyl)-, (4E)- [ACD/Index Name]
41137-87-5 [RN]
hirsutene
Hirsutenone
MFCD20274778

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

Density: 1.3±0.1 g/cm3
Boiling Point: 622.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.5±3.0 kJ/mol
Flash Point: 344.0±28.0 °C
Index of Refraction: 1.649
Molar Refractivity: 91.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.16
ACD/LogD (pH 5.5): 2.71
ACD/BCF (pH 5.5): 67.89
ACD/KOC (pH 5.5): 712.50
ACD/LogD (pH 7.4): 2.71
ACD/BCF (pH 7.4): 66.89
ACD/KOC (pH 7.4): 702.05
Polar Surface Area: 98 Å2
Polarizability: 36.1±0.5 10-24cm3
Surface Tension: 64.1±3.0 dyne/cm
Molar Volume: 249.9±3.0 cm3

Click to predict properties on the Chemicalize site


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