ChemSpider 2D Image | (1R,5R)-8-Methyl-8-azabicyclo[3.2.1]oct-3-yl 4-fluorobenzoate | C15H18FNO2

(1R,5R)-8-Methyl-8-azabicyclo[3.2.1]oct-3-yl 4-fluorobenzoate

  • Molecular FormulaC15H18FNO2
  • Average mass263.307 Da
  • Monoisotopic mass263.132172 Da
  • ChemSpider ID27471711

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(1R,5R)-8-Methyl-8-azabicyclo[3.2.1]oct-3-yl 4-fluorobenzoate [ACD/IUPAC Name]
(1R,5R)-8-Methyl-8-azabicyclo[3.2.1]oct-3-yl-4-fluorbenzoat [German] [ACD/IUPAC Name]
4-Fluorobenzoate de (1R,5R)-8-méthyl-8-azabicyclo[3.2.1]oct-3-yle [French] [ACD/IUPAC Name]
Benzoic acid, 4-fluoro-, (1R,5R)-8-methyl-8-azabicyclo[3.2.1]oct-3-yl ester [ACD/Index Name]
4-FLUOROTROPACOCAINE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 344.0±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 58.8±3.0 kJ/mol
Flash Point: 161.8±25.1 °C
Index of Refraction: 1.561
Molar Refractivity: 70.1±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.29
ACD/LogD (pH 5.5): -0.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.04
Polar Surface Area: 30 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 44.2±5.0 dyne/cm
Molar Volume: 216.5±5.0 cm3

Click to predict properties on the Chemicalize site


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