ChemSpider 2D Image | 2-(4-Bromobutyl)-1,3-dioxolane | C7H13BrO2

2-(4-Bromobutyl)-1,3-dioxolane

  • Molecular FormulaC7H13BrO2
  • Average mass209.081 Da
  • Monoisotopic mass208.009888 Da
  • ChemSpider ID24589659

More details:






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

1,3-Dioxolane, 2-(4-bromobutyl)- [ACD/Index Name]
2-(4-Brombutyl)-1,3-dioxolan [German] [ACD/IUPAC Name]
2-(4-Bromobutyl)-1,3-dioxolane [ACD/IUPAC Name]
2-(4-Bromobutyl)-1,3-dioxolane [French] [ACD/IUPAC Name]
5-bromovaleraldehyde ethylene acetal
5-BromovaleraldehydeEthyleneAcetal
87227-41-6 [RN]
MFCD02093454 [MDL number]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 237.6±15.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.5 mmHg at 25°C
Enthalpy of Vaporization: 45.5±3.0 kJ/mol
Flash Point: 97.4±11.7 °C
Index of Refraction: 1.473
Molar Refractivity: 43.4±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.22
ACD/LogD (pH 5.5): 1.49
ACD/BCF (pH 5.5): 8.04
ACD/KOC (pH 5.5): 154.71
ACD/LogD (pH 7.4): 1.49
ACD/BCF (pH 7.4): 8.04
ACD/KOC (pH 7.4): 154.71
Polar Surface Area: 18 Å2
Polarizability: 17.2±0.5 10-24cm3
Surface Tension: 38.6±3.0 dyne/cm
Molar Volume: 154.6±3.0 cm3

Click to predict properties on the Chemicalize site





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