ChemSpider 2D Image | (2E)-1-(2,4-Dimethoxyphenyl)-3-[(3R)-3-(2,4-dimethoxyphenyl)-8,8-dimethyl-3,4-dihydro-2H,8H-pyrano[2,3-f]chromen-6-yl]-2-propen-1-one | C33H34O7

(2E)-1-(2,4-Dimethoxyphenyl)-3-[(3R)-3-(2,4-dimethoxyphenyl)-8,8-dimethyl-3,4-dihydro-2H,8H-pyrano[2,3-f]chromen-6-yl]-2-propen-1-one

  • Molecular FormulaC33H34O7
  • Average mass542.619 Da
  • Monoisotopic mass542.230469 Da
  • ChemSpider ID44205694

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2E)-1-(2,4-Dimethoxyphenyl)-3-[(3R)-3-(2,4-dimethoxyphenyl)-8,8-dimethyl-3,4-dihydro-2H,8H-pyrano[2,3-f]chromen-6-yl]-2-propen-1-on [German] [ACD/IUPAC Name]
(2E)-1-(2,4-Dimethoxyphenyl)-3-[(3R)-3-(2,4-dimethoxyphenyl)-8,8-dimethyl-3,4-dihydro-2H,8H-pyrano[2,3-f]chromen-6-yl]-2-propen-1-one [ACD/IUPAC Name]
(2E)-1-(2,4-Diméthoxyphényl)-3-[(3R)-3-(2,4-diméthoxyphényl)-8,8-diméthyl-3,4-dihydro-2H,8H-pyrano[2,3-f]chromén-6-yl]-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 1-(2,4-dimethoxyphenyl)-3-[(3R)-3-(2,4-dimethoxyphenyl)-3,4-dihydro-8,8-dimethyl-2H,8H-benzo[1,2-b:3,4-b']dipyran-6-yl]-, (2E)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 721.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.4±3.0 kJ/mol
Flash Point: 301.6±32.9 °C
Index of Refraction: 1.592
Molar Refractivity: 154.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 7.12
ACD/LogD (pH 5.5): 6.65
ACD/BCF (pH 5.5): 66759.70
ACD/KOC (pH 5.5): 98848.01
ACD/LogD (pH 7.4): 6.65
ACD/BCF (pH 7.4): 66759.70
ACD/KOC (pH 7.4): 98848.01
Polar Surface Area: 72 Å2
Polarizability: 61.3±0.5 10-24cm3
Surface Tension: 45.3±3.0 dyne/cm
Molar Volume: 457.5±3.0 cm3

Click to predict properties on the Chemicalize site


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