ChemSpider 2D Image | 1-(Anilinomethyl)-5-phenyl-1,3,5-triazinane-2-thione | C16H18N4S

1-(Anilinomethyl)-5-phenyl-1,3,5-triazinane-2-thione

  • Molecular FormulaC16H18N4S
  • Average mass298.406 Da
  • Monoisotopic mass298.125214 Da
  • ChemSpider ID21118307

More details:

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

1-(Anilinomethyl)-5-phenyl-1,3,5-triazinane-2-thione [ACD/IUPAC Name]
1-(Anilinométhyl)-5-phényl-1,3,5-triazinane-2-thione [French] [ACD/IUPAC Name]
1,3,5-Triazine-2(1H)-thione, tetrahydro-5-phenyl-1-[(phenylamino)methyl]- [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: 495.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.3±3.0 kJ/mol
Flash Point: 253.4±31.5 °C
Index of Refraction: 1.658
Molar Refractivity: 90.0±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.52
ACD/LogD (pH 5.5): -0.41
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.03
ACD/LogD (pH 7.4): -0.41
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.03
Polar Surface Area: 70 Å2
Polarizability: 35.7±0.5 10-24cm3
Surface Tension: 48.3±7.0 dyne/cm
Molar Volume: 244.4±7.0 cm3

Click to predict properties on the Chemicalize site


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