ChemSpider 2D Image | Phenyl 4-[(diethoxyphosphoryl)methyl]benzoate | C18H21O5P

Phenyl 4-[(diethoxyphosphoryl)methyl]benzoate

  • Molecular FormulaC18H21O5P
  • Average mass348.330 Da
  • Monoisotopic mass348.112671 Da
  • ChemSpider ID28671948

More details:

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

4-[(Diéthoxyphosphoryl)méthyl]benzoate de phényle [French] [ACD/IUPAC Name]
Benzoic acid, 4-[(diethoxyphosphinyl)methyl]-, phenyl ester [ACD/Index Name]
Phenyl 4-[(diethoxyphosphoryl)methyl]benzoate [ACD/IUPAC Name]
Phenyl-4-[(diethoxyphosphoryl)methyl]benzoat [German] [ACD/IUPAC Name]
112164-06-4 [RN]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 492.3±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.9±3.0 kJ/mol
Flash Point: 264.7±47.1 °C
Index of Refraction: 1.541
Molar Refractivity: 91.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.43
ACD/LogD (pH 5.5): 3.44
ACD/BCF (pH 5.5): 243.70
ACD/KOC (pH 5.5): 1778.75
ACD/LogD (pH 7.4): 3.44
ACD/BCF (pH 7.4): 243.70
ACD/KOC (pH 7.4): 1778.75
Polar Surface Area: 72 Å2
Polarizability: 36.4±0.5 10-24cm3
Surface Tension: 44.0±3.0 dyne/cm
Molar Volume: 292.1±3.0 cm3

Click to predict properties on the Chemicalize site


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