ChemSpider 2D Image | 1-[3-(4-Fluorophenoxy)propyl]-4-[(4-methoxy-3-nitrophenyl)sulfonyl]piperazine | C20H24FN3O6S

1-[3-(4-Fluorophenoxy)propyl]-4-[(4-methoxy-3-nitrophenyl)sulfonyl]piperazine

  • Molecular FormulaC20H24FN3O6S
  • Average mass453.484 Da
  • Monoisotopic mass453.136993 Da
  • ChemSpider ID22035926

More details:

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

1-[3-(4-Fluorophenoxy)propyl]-4-[(4-methoxy-3-nitrophenyl)sulfonyl]piperazine [ACD/IUPAC Name]
1-[3-(4-Fluorophénoxy)propyl]-4-[(4-méthoxy-3-nitrophényl)sulfonyl]pipérazine [French] [ACD/IUPAC Name]
1-[3-(4-Fluorphenoxy)propyl]-4-[(4-methoxy-3-nitrophenyl)sulfonyl]piperazin [German] [ACD/IUPAC Name]
Piperazine, 1-[3-(4-fluorophenoxy)propyl]-4-[(4-methoxy-3-nitrophenyl)sulfonyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 621.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.0±3.0 kJ/mol
Flash Point: 329.4±34.3 °C
Index of Refraction: 1.580
Molar Refractivity: 112.7±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.48
ACD/LogD (pH 5.5): 1.72
ACD/BCF (pH 5.5): 4.75
ACD/KOC (pH 5.5): 35.38
ACD/LogD (pH 7.4): 3.19
ACD/BCF (pH 7.4): 140.50
ACD/KOC (pH 7.4): 1047.54
Polar Surface Area: 113 Å2
Polarizability: 44.7±0.5 10-24cm3
Surface Tension: 51.0±3.0 dyne/cm
Molar Volume: 338.4±3.0 cm3

Click to predict properties on the Chemicalize site


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