ChemSpider 2D Image | (2R)-1-[(4-Methylphenyl)sulfonyl]-2-[(1S)-1-phenylethyl]aziridine | C17H19NO2S

(2R)-1-[(4-Methylphenyl)sulfonyl]-2-[(1S)-1-phenylethyl]aziridine

  • Molecular FormulaC17H19NO2S
  • Average mass301.403 Da
  • Monoisotopic mass301.113647 Da
  • ChemSpider ID30658638

  • defined stereocentres - 2 of 3 defined stereocentres

More details:

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

(2R)-1-[(4-Methylphenyl)sulfonyl]-2-[(1S)-1-phenylethyl]aziridin [German] [ACD/IUPAC Name]
(2R)-1-[(4-Methylphenyl)sulfonyl]-2-[(1S)-1-phenylethyl]aziridine [ACD/IUPAC Name]
(2R)-1-[(4-Méthylphényl)sulfonyl]-2-[(1S)-1-phényléthyl]aziridine [French] [ACD/IUPAC Name]
Aziridine, 1-[(4-methylphenyl)sulfonyl]-2-[(1S)-1-phenylethyl]-, (2R)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 434.8±38.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 69.1±3.0 kJ/mol
Flash Point: 216.8±26.8 °C
Index of Refraction: 1.618
Molar Refractivity: 85.2±0.4 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.66
ACD/LogD (pH 5.5): 3.69
ACD/BCF (pH 5.5): 378.24
ACD/KOC (pH 5.5): 2436.54
ACD/LogD (pH 7.4): 3.69
ACD/BCF (pH 7.4): 378.24
ACD/KOC (pH 7.4): 2436.54
Polar Surface Area: 46 Å2
Polarizability: 33.8±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 243.4±3.0 cm3

Click to predict properties on the Chemicalize site


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