ChemSpider 2D Image | (2E)-3-{2,4-Dimethoxy-6-[(E)-2-(4-methoxyphenyl)vinyl]phenyl}-1-[4-(2-pentanyloxy)phenyl]-2-propen-1-one | C31H34O5

(2E)-3-{2,4-Dimethoxy-6-[(E)-2-(4-methoxyphenyl)vinyl]phenyl}-1-[4-(2-pentanyloxy)phenyl]-2-propen-1-one

  • Molecular FormulaC31H34O5
  • Average mass486.599 Da
  • Monoisotopic mass486.240631 Da
  • ChemSpider ID26337360

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-{2,4-Dimethoxy-6-[(E)-2-(4-methoxyphenyl)vinyl]phenyl}-1-[4-(2-pentanyloxy)phenyl]-2-propen-1-on [German] [ACD/IUPAC Name]
(2E)-3-{2,4-Dimethoxy-6-[(E)-2-(4-methoxyphenyl)vinyl]phenyl}-1-[4-(2-pentanyloxy)phenyl]-2-propen-1-one [ACD/IUPAC Name]
(2E)-3-{2,4-Diméthoxy-6-[(E)-2-(4-méthoxyphényl)vinyl]phényl}-1-[4-(2-pentanyloxy)phényl]-2-propén-1-one [French] [ACD/IUPAC Name]
2-Propen-1-one, 3-[2,4-dimethoxy-6-[(E)-2-(4-methoxyphenyl)ethenyl]phenyl]-1-[4-(1-methylbutoxy)phenyl]-, (2E)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 664.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.7±3.0 kJ/mol
Flash Point: 279.5±31.5 °C
Index of Refraction: 1.604
Molar Refractivity: 149.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 8.63
ACD/LogD (pH 5.5): 7.42
ACD/BCF (pH 5.5): 258303.53
ACD/KOC (pH 5.5): 260361.89
ACD/LogD (pH 7.4): 7.42
ACD/BCF (pH 7.4): 258303.53
ACD/KOC (pH 7.4): 260361.89
Polar Surface Area: 54 Å2
Polarizability: 59.3±0.5 10-24cm3
Surface Tension: 42.0±3.0 dyne/cm
Molar Volume: 435.4±3.0 cm3

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