ChemSpider 2D Image | 3-[4-({Bis[(3-phenylpropanoyl)oxy]phosphoryl}methyl)phenyl]propanoic acid | C28H29O7P

3-[4-({Bis[(3-phenylpropanoyl)oxy]phosphoryl}methyl)phenyl]propanoic acid

  • Molecular FormulaC28H29O7P
  • Average mass508.499 Da
  • Monoisotopic mass508.165100 Da
  • ChemSpider ID8227549

More details:

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

3-[4-({Bis[(3-phenylpropanoyl)oxy]phosphoryl}methyl)phenyl]propanoic acid [ACD/IUPAC Name]
3-[4-({Bis[(3-phenylpropanoyl)oxy]phosphoryl}methyl)phenyl]propansäure [German] [ACD/IUPAC Name]
Acide 3-[4-({bis[(3-phénylpropanoyl)oxy]phosphoryl}méthyl)phényl]propanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, 4-[[bis(1-oxo-3-phenylpropoxy)phosphinyl]methyl]- [ACD/Index 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: 677.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 104.5±3.0 kJ/mol
Flash Point: 363.5±34.3 °C
Index of Refraction: 1.583
Molar Refractivity: 134.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 1
ACD/LogP: 4.16
ACD/LogD (pH 5.5): 3.56
ACD/BCF (pH 5.5): 176.17
ACD/KOC (pH 5.5): 761.47
ACD/LogD (pH 7.4): 1.75
ACD/BCF (pH 7.4): 2.77
ACD/KOC (pH 7.4): 11.97
Polar Surface Area: 117 Å2
Polarizability: 53.2±0.5 10-24cm3
Surface Tension: 53.8±3.0 dyne/cm
Molar Volume: 401.2±3.0 cm3

Click to predict properties on the Chemicalize site


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