ChemSpider 2D Image | O-Ethyl O-phenyl (4-nitrophenyl)phosphonothioate | C14H14NO4PS

O-Ethyl O-phenyl (4-nitrophenyl)phosphonothioate

  • Molecular FormulaC14H14NO4PS
  • Average mass323.304 Da
  • Monoisotopic mass323.038116 Da
  • ChemSpider ID67025969

More details:

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

(4-Nitrophényl)phosphonothioate de O-éthyle et de O-phényle [French] [ACD/IUPAC Name]
O-Ethyl O-phenyl (4-nitrophenyl)phosphonothioate [ACD/IUPAC Name]
O-Ethyl-O-phenyl-(4-nitrophenyl)phosphonothioat [German] [ACD/IUPAC Name]
Phosphonothioic acid, P-(4-nitrophenyl)-, O-ethyl O-phenyl ester [ACD/Index Name]
ethyl p-nitrophenylphenylthiophosphonic acid

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

Density: 1.3±0.1 g/cm3
Boiling Point: 428.9±47.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 65.8±3.0 kJ/mol
Flash Point: 213.2±29.3 °C
Index of Refraction: 1.613
Molar Refractivity: 84.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.43
ACD/LogD (pH 5.5): 4.19
ACD/BCF (pH 5.5): 902.23
ACD/KOC (pH 5.5): 4539.59
ACD/LogD (pH 7.4): 4.19
ACD/BCF (pH 7.4): 902.23
ACD/KOC (pH 7.4): 4539.59
Polar Surface Area: 106 Å2
Polarizability: 33.3±0.5 10-24cm3
Surface Tension: 59.0±5.0 dyne/cm
Molar Volume: 241.1±5.0 cm3

Click to predict properties on the Chemicalize site


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