ChemSpider 2D Image | 1-(4-Iodobutyl)pyrene | C20H17I

1-(4-Iodobutyl)pyrene

  • Molecular FormulaC20H17I
  • Average mass384.253 Da
  • Monoisotopic mass384.037476 Da
  • ChemSpider ID26668411

More details:

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

1-(4-Iodbutyl)pyren [German] [ACD/IUPAC Name]
1-(4-Iodobutyl)pyrene [ACD/IUPAC Name]
1-(4-Iodobutyl)pyrène [French] [ACD/IUPAC Name]
Pyrene, 1-(4-iodobutyl)- [ACD/Index Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 495.2±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.4±3.0 kJ/mol
Flash Point: 251.0±17.2 °C
Index of Refraction: 1.788
Molar Refractivity: 104.2±0.3 cm3
#H bond acceptors: 0
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 7.50
ACD/LogD (pH 5.5): 7.01
ACD/BCF (pH 5.5): 126104.87
ACD/KOC (pH 5.5): 155841.02
ACD/LogD (pH 7.4): 7.01
ACD/BCF (pH 7.4): 126104.87
ACD/KOC (pH 7.4): 155841.02
Polar Surface Area: 0 Å2
Polarizability: 41.3±0.5 10-24cm3
Surface Tension: 57.7±3.0 dyne/cm
Molar Volume: 246.6±3.0 cm3

Click to predict properties on the Chemicalize site


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