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Search term: AVHKTHBPPDGCMI (Found by InChIKey (skeleton match))

ChemSpider 2D Image | (1E,6E)-4-(3,4-Dimethoxybenzylidene)-1,7-bis(3,4,5-trimethoxyphenyl)-1,6-heptadiene-3,5-dione | C34H36O10

(1E,6E)-4-(3,4-Dimethoxybenzylidene)-1,7-bis(3,4,5-trimethoxyphenyl)-1,6-heptadiene-3,5-dione

  • Molecular FormulaC34H36O10
  • Average mass604.644 Da
  • Monoisotopic mass604.230835 Da
  • ChemSpider ID26631160
  • Double-bond stereo - Double-bond stereo


More details:






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

(1E,6E)-4-(3,4-Dimethoxybenzyliden)-1,7-bis(3,4,5-trimethoxyphenyl)-1,6-heptadien-3,5-dion [German] [ACD/IUPAC Name]
(1E,6E)-4-(3,4-Dimethoxybenzylidene)-1,7-bis(3,4,5-trimethoxyphenyl)-1,6-heptadiene-3,5-dione [ACD/IUPAC Name]
(1E,6E)-4-(3,4-Diméthoxybenzylidène)-1,7-bis(3,4,5-triméthoxyphényl)-1,6-heptadiène-3,5-dione [French] [ACD/IUPAC Name]
1,6-Heptadiene-3,5-dione, 4-[(3,4-dimethoxyphenyl)methylene]-1,7-bis(3,4,5-trimethoxyphenyl)-, (1E,6E)- [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: 766.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.7±3.0 kJ/mol
Flash Point: 221.5±27.0 °C
Index of Refraction: 1.594
Molar Refractivity: 171.0±0.3 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: 6.08
ACD/LogD (pH 5.5): 4.37
ACD/BCF (pH 5.5): 1225.87
ACD/KOC (pH 5.5): 5653.38
ACD/LogD (pH 7.4): 4.37
ACD/BCF (pH 7.4): 1225.87
ACD/KOC (pH 7.4): 5653.38
Polar Surface Area: 108 Å2
Polarizability: 67.8±0.5 10-24cm3
Surface Tension: 42.5±3.0 dyne/cm
Molar Volume: 503.7±3.0 cm3

Click to predict properties on the Chemicalize site






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