ChemSpider 2D Image | azothoate | C14H14ClN2O3PS

azothoate

  • Molecular FormulaC14H14ClN2O3PS
  • Average mass356.764 Da
  • Monoisotopic mass356.015137 Da
  • ChemSpider ID21172182

More details:

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

227-419-3 [EINECS]
5834-96-8 [RN]
azothoate [ISO]
O-{4-[(4-Chlorophenyl)diazenyl]phenyl} O,O-dimethyl phosphorothioate [ACD/IUPAC Name]
O-{4-[(4-Chlorphenyl)diazenyl]phenyl}-O,O-dimethylphosphorothioat [German] [ACD/IUPAC Name]
Phosphorothioate de O-{4-[(4-chlorophényl)diazényl]phényle} et de O,O-diméthyle [French] [ACD/IUPAC Name]
Phosphorothioic acid, O-[4-[2-(4-chlorophenyl)diazenyl]phenyl] O,O-dimethyl ester [ACD/Index Name]
азотоат [Russian]
O-(PARA-(PARA-CHLOROPHENYLAZO)PHENYL) O,O-DIMETHYL PHOSPHOROTHIOATE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 447.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.8±3.0 kJ/mol
Flash Point: 224.3±31.5 °C
Index of Refraction: 1.596
Molar Refractivity: 90.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.64
ACD/LogD (pH 5.5): 4.90
ACD/BCF (pH 5.5): 3094.82
ACD/KOC (pH 5.5): 10969.61
ACD/LogD (pH 7.4): 4.90
ACD/BCF (pH 7.4): 3094.82
ACD/KOC (pH 7.4): 10969.61
Polar Surface Area: 94 Å2
Polarizability: 35.9±0.5 10-24cm3
Surface Tension: 46.8±7.0 dyne/cm
Molar Volume: 266.6±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement