ChemSpider 2D Image | [(2R,3S)-2,3-Dimethyl-1-aziridinyl](phenyl)methanone | C11H13NO

[(2R,3S)-2,3-Dimethyl-1-aziridinyl](phenyl)methanone

  • Molecular FormulaC11H13NO
  • Average mass175.227 Da
  • Monoisotopic mass175.099716 Da
  • ChemSpider ID74158799

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

[(2R,3S)-2,3-Dimethyl-1-aziridinyl](phenyl)methanon [German] [ACD/IUPAC Name]
[(2R,3S)-2,3-Dimethyl-1-aziridinyl](phenyl)methanone [ACD/IUPAC Name]
[(2R,3S)-2,3-Diméthyl-1-aziridinyl](phényl)méthanone [French] [ACD/IUPAC Name]
Methanone, [(2R,3S)-2,3-dimethyl-1-aziridinyl]phenyl- [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: 280.8±9.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.0±3.0 kJ/mol
Flash Point: 123.3±9.9 °C
Index of Refraction: 1.556
Molar Refractivity: 51.9±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 0.73
ACD/LogD (pH 5.5): 1.18
ACD/BCF (pH 5.5): 4.67
ACD/KOC (pH 5.5): 104.86
ACD/LogD (pH 7.4): 1.18
ACD/BCF (pH 7.4): 4.67
ACD/KOC (pH 7.4): 104.86
Polar Surface Area: 20 Å2
Polarizability: 20.6±0.5 10-24cm3
Surface Tension: 38.5±3.0 dyne/cm
Molar Volume: 161.3±3.0 cm3

Click to predict properties on the Chemicalize site


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