ChemSpider 2D Image | Ethyl 4-methyl-3-oxo-2-(triphenylphosphoranylidene)pentanoate | C26H27O3P

Ethyl 4-methyl-3-oxo-2-(triphenylphosphoranylidene)pentanoate

  • Molecular FormulaC26H27O3P
  • Average mass418.465 Da
  • Monoisotopic mass418.169769 Da
  • ChemSpider ID35797784

More details:

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

4-Méthyl-3-oxo-2-(triphénylphosphoranylidène)pentanoate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 4-methyl-3-oxo-2-(triphenylphosphoranylidene)pentanoate [ACD/IUPAC Name]
Ethyl-4-methyl-3-oxo-2-(triphenylphosphoranyliden)pentanoat [German] [ACD/IUPAC Name]
Pentanoic acid, 4-methyl-3-oxo-2-(triphenylphosphoranylidene)-, ethyl ester [ACD/Index Name]
PENTANOIC ACID, 4-METHYL-3-OXO-2-(TRIPHENYLPHOSPHORANYLIDENE)-, ETHYLESTER

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

Density: 1.2±0.1 g/cm3
Boiling Point: 547.4±33.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 82.7±3.0 kJ/mol
Flash Point: 297.8±45.7 °C
Index of Refraction: 1.584
Molar Refractivity: 121.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.57
ACD/LogD (pH 5.5): 4.95
ACD/BCF (pH 5.5): 3393.00
ACD/KOC (pH 5.5): 11716.20
ACD/LogD (pH 7.4): 4.95
ACD/BCF (pH 7.4): 3393.00
ACD/KOC (pH 7.4): 11716.20
Polar Surface Area: 53 Å2
Polarizability: 48.1±0.5 10-24cm3
Surface Tension: 46.7±5.0 dyne/cm
Molar Volume: 362.3±5.0 cm3

Click to predict properties on the Chemicalize site


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