ChemSpider 2D Image | (3S)-3-Amino-N,N-dimethyl-3-phenylpropanamide | C11H16N2O

(3S)-3-Amino-N,N-dimethyl-3-phenylpropanamide

  • Molecular FormulaC11H16N2O
  • Average mass192.258 Da
  • Monoisotopic mass192.126266 Da
  • ChemSpider ID75697600

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-3-Amino-N,N-dimethyl-3-phenylpropanamid [German] [ACD/IUPAC Name]
(3S)-3-Amino-N,N-dimethyl-3-phenylpropanamide [ACD/IUPAC Name]
(3S)-3-Amino-N,N-diméthyl-3-phénylpropanamide [French] [ACD/IUPAC Name]
Benzenepropanamide, β-amino-N,N-dimethyl-, (βS)- [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: 333.3±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.6±3.0 kJ/mol
Flash Point: 155.4±25.9 °C
Index of Refraction: 1.544
Molar Refractivity: 57.0±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.55
ACD/LogD (pH 5.5): -1.46
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 18.39
Polar Surface Area: 46 Å2
Polarizability: 22.6±0.5 10-24cm3
Surface Tension: 42.7±3.0 dyne/cm
Molar Volume: 180.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement