ChemSpider 2D Image | Ethyl (2E)-[3,5-bis(4-methoxyphenyl)-2,4-cycloheptadien-1-ylidene]acetate | C25H26O4

Ethyl (2E)-[3,5-bis(4-methoxyphenyl)-2,4-cycloheptadien-1-ylidene]acetate

  • Molecular FormulaC25H26O4
  • Average mass390.471 Da
  • Monoisotopic mass390.183105 Da
  • ChemSpider ID30658596

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-[3,5-Bis(4-méthoxyphényl)-2,4-cycloheptadién-1-ylidène]acétate d'éthyle [French] [ACD/IUPAC Name]
Acetic acid, 2-[3,5-bis(4-methoxyphenyl)-2,4-cycloheptadien-1-ylidene]-, ethyl ester, (2E)- [ACD/Index Name]
Ethyl (2E)-[3,5-bis(4-methoxyphenyl)-2,4-cycloheptadien-1-ylidene]acetate [ACD/IUPAC Name]
Ethyl-(2E)-[3,5-bis(4-methoxyphenyl)-2,4-cycloheptadien-1-yliden]acetat [German] [ACD/IUPAC 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: 562.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.6±3.0 kJ/mol
Flash Point: 243.2±30.2 °C
Index of Refraction: 1.603
Molar Refractivity: 115.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.88
ACD/LogD (pH 5.5): 4.94
ACD/BCF (pH 5.5): 3327.33
ACD/KOC (pH 5.5): 11553.43
ACD/LogD (pH 7.4): 4.94
ACD/BCF (pH 7.4): 3327.33
ACD/KOC (pH 7.4): 11553.43
Polar Surface Area: 45 Å2
Polarizability: 45.8±0.5 10-24cm3
Surface Tension: 47.2±3.0 dyne/cm
Molar Volume: 336.8±3.0 cm3

Click to predict properties on the Chemicalize site


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