ChemSpider 2D Image | Ethyl 3-ethoxy-4-(triphenylphosphoranylidene)-2-butenoate | C26H27O3P

Ethyl 3-ethoxy-4-(triphenylphosphoranylidene)-2-butenoate

  • Molecular FormulaC26H27O3P
  • Average mass418.465 Da
  • Monoisotopic mass418.169769 Da
  • ChemSpider ID57535179

More details:

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

2-BUTENOIC ACID, 3-ETHOXY-4-(TRIPHENYLPHOSPHORANYLIDENE)-, ETHYL ESTER [ACD/Index Name]
3-Éthoxy-4-(triphénylphosphoranylidène)-2-buténoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 3-ethoxy-4-(triphenylphosphoranylidene)-2-butenoate [ACD/IUPAC Name]
Ethyl-3-ethoxy-4-(triphenylphosphoranyliden)-2-butenoat [German] [ACD/IUPAC Name]
27271-28-9 [RN]
Ethyl 3-ethoxy-4-(triphenyl-λ5-phosphanylidene)but-2-enoate

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

Density: 1.1±0.1 g/cm3
Boiling Point: 560.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.3±3.0 kJ/mol
Flash Point: 305.8±53.2 °C
Index of Refraction: 1.589
Molar Refractivity: 122.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.72
ACD/LogD (pH 5.5): 5.11
ACD/BCF (pH 5.5): 4523.71
ACD/KOC (pH 5.5): 14394.50
ACD/LogD (pH 7.4): 5.11
ACD/BCF (pH 7.4): 4523.71
ACD/KOC (pH 7.4): 14394.50
Polar Surface Area: 45 Å2
Polarizability: 48.7±0.5 10-24cm3
Surface Tension: 46.6±5.0 dyne/cm
Molar Volume: 364.2±5.0 cm3

Click to predict properties on the Chemicalize site


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