ChemSpider 2D Image | Dimethyl 2,2'-{(2-oxo-1,3-cyclopentanediylidene)bis[(E)methylylidene-2,1-phenyleneoxy]}diacetate | C25H24O7

Dimethyl 2,2'-{(2-oxo-1,3-cyclopentanediylidene)bis[(E)methylylidene-2,1-phenyleneoxy]}diacetate

  • Molecular FormulaC25H24O7
  • Average mass436.454 Da
  • Monoisotopic mass436.152191 Da
  • ChemSpider ID31017326

  • Double-bond stereo - Double-bond stereo

More details:

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

2,2'-{(2-Oxo-1,3-cyclopentanediylidène)bis[(E)méthylylidène-2,1-phénylèneoxy]}diacétate de diméthyle [French] [ACD/IUPAC Name]
Acetic acid, 2,2'-[(2-oxo-1,3-cyclopentanediylidene)bis[(E)methylidyne-2,1-phenyleneoxy]]bis-, dimethyl ester [ACD/Index Name]
Dimethyl 2,2'-{(2-oxo-1,3-cyclopentanediylidene)bis[(E)methylylidene-2,1-phenyleneoxy]}diacetate [ACD/IUPAC Name]
Dimethyl-2,2'-{(2-oxo-1,3-cyclopentandiyliden)bis[(E)methylyliden-2,1-phenylenoxy]}diacetat [German] [ACD/IUPAC 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: 618.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 91.7±3.0 kJ/mol
Flash Point: 266.2±31.5 °C
Index of Refraction: 1.619
Molar Refractivity: 119.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 4.11
ACD/LogD (pH 5.5): 3.87
ACD/BCF (pH 5.5): 509.67
ACD/KOC (pH 5.5): 3016.34
ACD/LogD (pH 7.4): 3.87
ACD/BCF (pH 7.4): 509.67
ACD/KOC (pH 7.4): 3016.34
Polar Surface Area: 88 Å2
Polarizability: 47.5±0.5 10-24cm3
Surface Tension: 54.8±3.0 dyne/cm
Molar Volume: 341.8±3.0 cm3

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