ChemSpider 2D Image | (2S,3R)-1,2-Diphenyl(3-~2~H_1_)aziridine | C14H12DN

(2S,3R)-1,2-Diphenyl(3-2H1)aziridine

  • Molecular FormulaC14H12DN
  • Average mass196.266 Da
  • Monoisotopic mass196.111069 Da
  • ChemSpider ID8901895

  • defined stereocentres - 1 of 2 defined stereocentres

    Non-standard isotope - Non-standard isotope

More details:

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

(2S,3R)-1,2-Diphenyl(3-2H1)aziridin [German] [ACD/IUPAC Name]
(2S,3R)-1,2-Diphenyl(3-2H1)aziridine [ACD/IUPAC Name]
(2S,3R)-1,2-Diphényl(3-2H1)aziridine [French] [ACD/IUPAC Name]
Aziridine-2-d, 1,3-diphenyl-, (2R,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: 327.0±31.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.9±3.0 kJ/mol
Flash Point: 137.7±21.7 °C
Index of Refraction: 1.633
Molar Refractivity: 61.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.87
ACD/LogD (pH 5.5): 2.97
ACD/BCF (pH 5.5): 104.53
ACD/KOC (pH 5.5): 955.62
ACD/LogD (pH 7.4): 2.99
ACD/BCF (pH 7.4): 110.29
ACD/KOC (pH 7.4): 1008.28
Polar Surface Area: 3 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 47.1±3.0 dyne/cm
Molar Volume: 172.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement