ChemSpider 2D Image | (1R)-2-[(4-Fluorobenzyl)oxy]-1-phenylethanamine | C15H16FNO

(1R)-2-[(4-Fluorobenzyl)oxy]-1-phenylethanamine

  • Molecular FormulaC15H16FNO
  • Average mass245.292 Da
  • Monoisotopic mass245.121597 Da
  • ChemSpider ID29272401

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1R)-2-[(4-Fluorbenzyl)oxy]-1-phenylethanamin [German] [ACD/IUPAC Name]
(1R)-2-[(4-Fluorobenzyl)oxy]-1-phenylethanamine [ACD/IUPAC Name]
(1R)-2-[(4-Fluorobenzyl)oxy]-1-phényléthanamine [French] [ACD/IUPAC Name]
Benzenemethanamine, α-[[(4-fluorophenyl)methoxy]methyl]-, (αR)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 356.2±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.1±3.0 kJ/mol
Flash Point: 169.2±25.1 °C
Index of Refraction: 1.568
Molar Refractivity: 70.2±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.37
ACD/LogD (pH 5.5): -0.21
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.29
ACD/BCF (pH 7.4): 2.63
ACD/KOC (pH 7.4): 28.18
Polar Surface Area: 35 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 43.4±3.0 dyne/cm
Molar Volume: 214.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement