ChemSpider 2D Image | 4-Nitrophenyl hydrogen (4-methylbenzyl)phosphonate | C14H14NO5P

4-Nitrophenyl hydrogen (4-methylbenzyl)phosphonate

  • Molecular FormulaC14H14NO5P
  • Average mass307.238 Da
  • Monoisotopic mass307.060974 Da
  • ChemSpider ID98610924

More details:

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

4-Nitrophenyl hydrogen (4-methylbenzyl)phosphonate [ACD/IUPAC Name]
4-Nitrophenyl-hydrogen(4-methylbenzyl)phosphonat [German] [ACD/IUPAC Name]
Hydrogéno(4-méthylbenzyl)phosphonate de 4-nitrophényle [French] [ACD/IUPAC Name]
Phosphonic acid, P-[(4-methylphenyl)methyl]-, mono(4-nitrophenyl) ester [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 497.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 80.6±3.0 kJ/mol
Flash Point: 254.4±31.5 °C
Index of Refraction: 1.606
Molar Refractivity: 77.2±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.73
ACD/LogD (pH 5.5): -1.25
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 102 Å2
Polarizability: 30.6±0.5 10-24cm3
Surface Tension: 58.1±3.0 dyne/cm
Molar Volume: 223.9±3.0 cm3

Click to predict properties on the Chemicalize site


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