ChemSpider 2D Image | N-[(2S)-1-Hydroxy-1-phenyl-2-propanyl]-N-methylacetamide | C12H17NO2

N-[(2S)-1-Hydroxy-1-phenyl-2-propanyl]-N-methylacetamide

  • Molecular FormulaC12H17NO2
  • Average mass207.269 Da
  • Monoisotopic mass207.125931 Da
  • ChemSpider ID71354338

  • defined stereocentres - 1 of 2 defined stereocentres

More details:

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

Acetamide, N-[(1S)-2-hydroxy-1-methyl-2-phenylethyl]-N-methyl- [ACD/Index Name]
N-[(2S)-1-Hydroxy-1-phenyl-2-propanyl]-N-methylacetamid [German] [ACD/IUPAC Name]
N-[(2S)-1-Hydroxy-1-phenyl-2-propanyl]-N-methylacetamide [ACD/IUPAC Name]
N-[(2S)-1-Hydroxy-1-phényl-2-propanyl]-N-méthylacétamide [French] [ACD/IUPAC Name]
5878-95-5 [RN]
84472-25-3 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 361.2±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.1±3.0 kJ/mol
Flash Point: 172.3±25.9 °C
Index of Refraction: 1.535
Molar Refractivity: 59.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.13
ACD/LogD (pH 5.5): 1.32
ACD/BCF (pH 5.5): 5.96
ACD/KOC (pH 5.5): 124.93
ACD/LogD (pH 7.4): 1.32
ACD/BCF (pH 7.4): 5.96
ACD/KOC (pH 7.4): 124.93
Polar Surface Area: 41 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 41.9±3.0 dyne/cm
Molar Volume: 191.3±3.0 cm3

Click to predict properties on the Chemicalize site


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