ChemSpider 2D Image | 1-[(E)-2-{2-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-3,5-dimethoxyphenyl}vinyl]-3,4-dimethoxy-2-(3-methyl-2-buten-1-yl)benzene | C33H44O4

1-[(E)-2-{2-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-3,5-dimethoxyphenyl}vinyl]-3,4-dimethoxy-2-(3-methyl-2-buten-1-yl)benzene

  • Molecular FormulaC33H44O4
  • Average mass504.700 Da
  • Monoisotopic mass504.323975 Da
  • ChemSpider ID31129549

  • Double-bond stereo - Double-bond stereo

More details:

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

1-[(E)-2-{2-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-3,5-dimethoxyphenyl}vinyl]-3,4-dimethoxy-2-(3-methyl-2-buten-1-yl)benzene [ACD/IUPAC Name]
1-[(E)-2-{2-[(2E)-3,7-Diméthyl-2,6-octadién-1-yl]-3,5-diméthoxyphényl}vinyl]-3,4-diméthoxy-2-(3-méthyl-2-butén-1-yl)benzène [French] [ACD/IUPAC Name]
1-[(E)-2-{2-[(2E)-3,7-Dimethyl-2,6-octadien-1-yl]-3,5-dimethoxyphenyl}vinyl]-3,4-dimethoxy-2-(3-methyl-2-buten-1-yl)benzol [German] [ACD/IUPAC Name]
Benzene, 1-[(E)-2-[2-[(2E)-3,7-dimethyl-2,6-octadien-1-yl]-3,5-dimethoxyphenyl]ethenyl]-3,4-dimethoxy-2-(3-methyl-2-buten-1-yl)- [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 619.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.4±3.0 kJ/mol
Flash Point: 90.2±38.3 °C
Index of Refraction: 1.559
Molar Refractivity: 160.1±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 10.71
ACD/LogD (pH 5.5): 9.07
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 2037259.13
ACD/LogD (pH 7.4): 9.07
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 2037259.13
Polar Surface Area: 37 Å2
Polarizability: 63.5±0.5 10-24cm3
Surface Tension: 35.3±3.0 dyne/cm
Molar Volume: 496.1±3.0 cm3

Click to predict properties on the Chemicalize site


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