ChemSpider 2D Image | (2R,3R)-5,7-Dimethoxy-4-oxo-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-chromen-3-yl (2E)-3-(4-methoxyphenyl)acrylate | C30H30O10

(2R,3R)-5,7-Dimethoxy-4-oxo-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-chromen-3-yl (2E)-3-(4-methoxyphenyl)acrylate

  • Molecular FormulaC30H30O10
  • Average mass550.553 Da
  • Monoisotopic mass550.183899 Da
  • ChemSpider ID59006332

  • Double-bond stereo - Double-bond stereo

    defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2E)-3-(4-Méthoxyphényl)acrylate de (2R,3R)-5,7-diméthoxy-4-oxo-2-(3,4,5-triméthoxyphényl)-3,4-dihydro-2H-chromén-3-yle [French] [ACD/IUPAC Name]
(2R,3R)-5,7-Dimethoxy-4-oxo-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-chromen-3-yl (2E)-3-(4-methoxyphenyl)acrylate [ACD/IUPAC Name]
(2R,3R)-5,7-Dimethoxy-4-oxo-2-(3,4,5-trimethoxyphenyl)-3,4-dihydro-2H-chromen-3-yl-(2E)-3-(4-methoxyphenyl)acrylat [German] [ACD/IUPAC Name]
2-Propenoic acid, 3-(4-methoxyphenyl)-, (2R,3R)-3,4-dihydro-5,7-dimethoxy-4-oxo-2-(3,4,5-trimethoxyphenyl)-2H-1-benzopyran-3-yl ester, (2E)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 722.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.5±3.0 kJ/mol
Flash Point: 303.0±32.9 °C
Index of Refraction: 1.602
Molar Refractivity: 143.7±0.4 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 4.85
ACD/LogD (pH 5.5): 4.12
ACD/BCF (pH 5.5): 794.14
ACD/KOC (pH 5.5): 4143.29
ACD/LogD (pH 7.4): 4.12
ACD/BCF (pH 7.4): 794.14
ACD/KOC (pH 7.4): 4143.29
Polar Surface Area: 108 Å2
Polarizability: 57.0±0.5 10-24cm3
Surface Tension: 56.2±5.0 dyne/cm
Molar Volume: 418.8±5.0 cm3

Click to predict properties on the Chemicalize site


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