ChemSpider 2D Image | 5-[2-(Nonylsulfonyl)propyl]-1,3-benzodioxole | C19H30O4S

5-[2-(Nonylsulfonyl)propyl]-1,3-benzodioxole

  • Molecular FormulaC19H30O4S
  • Average mass354.504 Da
  • Monoisotopic mass354.186493 Da
  • ChemSpider ID57512837

More details:

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

1,3-Benzodioxole, 5-[2-(nonylsulfonyl)propyl]- [ACD/Index Name]
5-[2-(Nonylsulfonyl)propyl]-1,3-benzodioxol [German] [ACD/IUPAC Name]
5-[2-(Nonylsulfonyl)propyl]-1,3-benzodioxole [ACD/IUPAC Name]
5-[2-(Nonylsulfonyl)propyl]-1,3-benzodioxole [French] [ACD/IUPAC Name]
5-[2-(NONANE-1-SULFONYL)PROPYL]-2H-1,3-BENZODIOXOLE
64699-94-1 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 508.9±29.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 75.0±3.0 kJ/mol
Flash Point: 261.6±24.3 °C
Index of Refraction: 1.519
Molar Refractivity: 97.2±0.4 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 5.53
ACD/LogD (pH 5.5): 5.50
ACD/BCF (pH 5.5): 8981.34
ACD/KOC (pH 5.5): 23517.53
ACD/LogD (pH 7.4): 5.50
ACD/BCF (pH 7.4): 8981.34
ACD/KOC (pH 7.4): 23517.53
Polar Surface Area: 61 Å2
Polarizability: 38.5±0.5 10-24cm3
Surface Tension: 42.7±3.0 dyne/cm
Molar Volume: 319.9±3.0 cm3

Click to predict properties on the Chemicalize site


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