ChemSpider 2D Image | (2S)-2-[(4-Chlorobenzyl)oxy]-2-phenylethanamine | C15H16ClNO

(2S)-2-[(4-Chlorobenzyl)oxy]-2-phenylethanamine

  • Molecular FormulaC15H16ClNO
  • Average mass261.747 Da
  • Monoisotopic mass261.092041 Da
  • ChemSpider ID26329315

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-2-[(4-Chlorbenzyl)oxy]-2-phenylethanamin [German] [ACD/IUPAC Name]
(2S)-2-[(4-Chlorobenzyl)oxy]-2-phenylethanamine [ACD/IUPAC Name]
(2S)-2-[(4-Chlorobenzyl)oxy]-2-phényléthanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, β-[(4-chlorophenyl)methoxy]-, (βS)- [ACD/Index Name]
VU2

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

Density: 1.2±0.1 g/cm3
Boiling Point: 378.9±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.7±3.0 kJ/mol
Flash Point: 182.9±25.1 °C
Index of Refraction: 1.591
Molar Refractivity: 75.1±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.02
ACD/LogD (pH 5.5): 1.34
ACD/BCF (pH 5.5): 1.65
ACD/KOC (pH 5.5): 10.47
ACD/LogD (pH 7.4): 3.05
ACD/BCF (pH 7.4): 84.04
ACD/KOC (pH 7.4): 534.03
Polar Surface Area: 35 Å2
Polarizability: 29.8±0.5 10-24cm3
Surface Tension: 46.1±3.0 dyne/cm
Molar Volume: 222.2±3.0 cm3

Click to predict properties on the Chemicalize site


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