ChemSpider 2D Image | 4-{4-[(3-Chlorobenzyl)oxy]bicyclo[2.2.1]hept-1-yl}butanoic acid | C18H23ClO3

4-{4-[(3-Chlorobenzyl)oxy]bicyclo[2.2.1]hept-1-yl}butanoic acid

  • Molecular FormulaC18H23ClO3
  • Average mass322.826 Da
  • Monoisotopic mass322.133575 Da
  • ChemSpider ID128961716

More details:

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

4-{4-[(3-Chlorbenzyl)oxy]bicyclo[2.2.1]hept-1-yl}butansäure [German] [ACD/IUPAC Name]
4-{4-[(3-Chlorobenzyl)oxy]bicyclo[2.2.1]hept-1-yl}butanoic acid [ACD/IUPAC Name]
Acide 4-{4-[(3-chlorobenzyl)oxy]bicyclo[2.2.1]hept-1-yl}butanoïque [French] [ACD/IUPAC Name]
Bicyclo[2.2.1]heptane-1-butanoic acid, 4-[(3-chlorophenyl)methoxy]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 452.7±20.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.0±3.0 kJ/mol
Flash Point: 227.6±21.8 °C
Index of Refraction: 1.575
Molar Refractivity: 86.5±0.4 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.42
ACD/LogD (pH 5.5): 3.74
ACD/BCF (pH 5.5): 271.06
ACD/KOC (pH 5.5): 1176.77
ACD/LogD (pH 7.4): 1.95
ACD/BCF (pH 7.4): 4.41
ACD/KOC (pH 7.4): 19.14
Polar Surface Area: 47 Å2
Polarizability: 34.3±0.5 10-24cm3
Surface Tension: 50.7±5.0 dyne/cm
Molar Volume: 261.5±5.0 cm3

Click to predict properties on the Chemicalize site


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