ChemSpider 2D Image | N-[(2S)-2-Amino-2-phenylethyl]-3-(4-chlorophenyl)-3-hydroxypropanamide | C17H19ClN2O2

N-[(2S)-2-Amino-2-phenylethyl]-3-(4-chlorophenyl)-3-hydroxypropanamide

  • Molecular FormulaC17H19ClN2O2
  • Average mass318.798 Da
  • Monoisotopic mass318.113495 Da
  • ChemSpider ID117242262

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

Benzenepropanamide, N-[(2S)-2-amino-2-phenylethyl]-4-chloro-β-hydroxy- [ACD/Index Name]
N-[(2S)-2-Amino-2-phenylethyl]-3-(4-chlorophenyl)-3-hydroxypropanamide [ACD/IUPAC Name]
N-[(2S)-2-Amino-2-phényléthyl]-3-(4-chlorophényl)-3-hydroxypropanamide [French] [ACD/IUPAC Name]
N-[(2S)-2-Amino-2-phenylethyl]-3-(4-chlorphenyl)-3-hydroxypropanamid [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 572.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.2±3.0 kJ/mol
Flash Point: 299.8±30.1 °C
Index of Refraction: 1.610
Molar Refractivity: 87.8±0.3 cm3
#H bond acceptors: 4
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.61
ACD/LogD (pH 5.5): -0.90
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.76
ACD/BCF (pH 7.4): 1.26
ACD/KOC (pH 7.4): 21.05
Polar Surface Area: 75 Å2
Polarizability: 34.8±0.5 10-24cm3
Surface Tension: 54.4±3.0 dyne/cm
Molar Volume: 253.0±3.0 cm3

Click to predict properties on the Chemicalize site


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