ChemSpider 2D Image | Dimethyl [(2R,3S)-3-(4-nitrophenyl)-2-phenyl-2-oxiranyl]phosphonate | C16H16NO6P

Dimethyl [(2R,3S)-3-(4-nitrophenyl)-2-phenyl-2-oxiranyl]phosphonate

  • Molecular FormulaC16H16NO6P
  • Average mass349.275 Da
  • Monoisotopic mass349.071533 Da
  • ChemSpider ID75555023

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

[(2R,3S)-3-(4-Nitrophényl)-2-phényl-2-oxiranyl]phosphonate de diméthyle [French] [ACD/IUPAC Name]
Dimethyl [(2R,3S)-3-(4-nitrophenyl)-2-phenyl-2-oxiranyl]phosphonate [ACD/IUPAC Name]
Dimethyl-[(2R,3S)-3-(4-nitrophenyl)-2-phenyl-2-oxiranyl]phosphonat [German] [ACD/IUPAC Name]
Phosphonic acid, P-[(2R,3S)-3-(4-nitrophenyl)-2-phenyloxiranyl]-, dimethyl 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: 493.6±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.2±3.0 kJ/mol
Flash Point: 252.3±28.7 °C
Index of Refraction: 1.593
Molar Refractivity: 85.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.11
ACD/LogD (pH 5.5): 2.23
ACD/BCF (pH 5.5): 29.41
ACD/KOC (pH 5.5): 391.51
ACD/LogD (pH 7.4): 2.23
ACD/BCF (pH 7.4): 29.41
ACD/KOC (pH 7.4): 391.51
Polar Surface Area: 104 Å2
Polarizability: 34.1±0.5 10-24cm3
Surface Tension: 55.3±5.0 dyne/cm
Molar Volume: 253.7±5.0 cm3

Click to predict properties on the Chemicalize site


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