ChemSpider 2D Image | (2S,3S)-3-(4-Methylphenyl)-2-phenyl(2-~2~H)oxirane | C15H13DO

(2S,3S)-3-(4-Methylphenyl)-2-phenyl(2-2H)oxirane

  • Molecular FormulaC15H13DO
  • Average mass211.277 Da
  • Monoisotopic mass211.110748 Da
  • ChemSpider ID28418734

  • defined stereocentres - 2 of 2 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(2S,3S)-3-(4-Methylphenyl)-2-phenyl(2-2H)oxiran [German] [ACD/IUPAC Name]
(2S,3S)-3-(4-Methylphenyl)-2-phenyl(2-2H)oxirane [ACD/IUPAC Name]
(2S,3S)-3-(4-Méthylphényl)-2-phényl(2-2H)oxirane [French] [ACD/IUPAC Name]
Oxirane-2-d, 3-(4-methylphenyl)-2-phenyl-, (2S,3S)- [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: 324.1±11.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 54.4±3.0 kJ/mol
Flash Point: 144.8±15.5 °C
Index of Refraction: 1.599
Molar Refractivity: 64.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 3.85
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 279.59
ACD/KOC (pH 5.5): 1962.57
ACD/LogD (pH 7.4): 3.52
ACD/BCF (pH 7.4): 279.59
ACD/KOC (pH 7.4): 1962.57
Polar Surface Area: 13 Å2
Polarizability: 25.6±0.5 10-24cm3
Surface Tension: 44.9±3.0 dyne/cm
Molar Volume: 188.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement