ChemSpider 2D Image | (2S)-1-(4-Chlorophenyl)-2-(dimethylamino)-1-propanone | C11H14ClNO

(2S)-1-(4-Chlorophenyl)-2-(dimethylamino)-1-propanone

  • Molecular FormulaC11H14ClNO
  • Average mass211.688 Da
  • Monoisotopic mass211.076385 Da
  • ChemSpider ID97478415

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1-(4-Chlorophenyl)-2-(dimethylamino)-1-propanone [ACD/IUPAC Name]
(2S)-1-(4-Chlorophényl)-2-(diméthylamino)-1-propanone [French] [ACD/IUPAC Name]
(2S)-1-(4-Chlorphenyl)-2-(dimethylamino)-1-propanon [German] [ACD/IUPAC Name]
1-Propanone, 1-(4-chlorophenyl)-2-(dimethylamino)-, (2S)- [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: 301.9±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 54.2±3.0 kJ/mol
Flash Point: 136.4±22.3 °C
Index of Refraction: 1.530
Molar Refractivity: 58.8±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.57
ACD/LogD (pH 5.5): 0.98
ACD/BCF (pH 5.5): 1.54
ACD/KOC (pH 5.5): 19.35
ACD/LogD (pH 7.4): 2.24
ACD/BCF (pH 7.4): 27.91
ACD/KOC (pH 7.4): 351.04
Polar Surface Area: 20 Å2
Polarizability: 23.3±0.5 10-24cm3
Surface Tension: 37.6±3.0 dyne/cm
Molar Volume: 190.1±3.0 cm3

Click to predict properties on the Chemicalize site


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