ChemSpider 2D Image | 1-[(E)-Benzylideneamino]-3,5-bis(2,2,2-trifluoroethyl)-1,3,5-triazinane-2,4,6-trione | C14H10F6N4O3

1-[(E)-Benzylideneamino]-3,5-bis(2,2,2-trifluoroethyl)-1,3,5-triazinane-2,4,6-trione

  • Molecular FormulaC14H10F6N4O3
  • Average mass396.245 Da
  • Monoisotopic mass396.065704 Da
  • ChemSpider ID34213201

  • Double-bond stereo - Double-bond stereo

More details:

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

1,3,5-Triazine-2,4,6(1H,3H,5H)-trione, 1-[[(1E)-phenylmethylene]amino]-3,5-bis(2,2,2-trifluoroethyl)- [ACD/Index Name]
1-[(E)-Benzylidenamino]-3,5-bis(2,2,2-trifluorethyl)-1,3,5-triazinan-2,4,6-trion [German] [ACD/IUPAC Name]
1-[(E)-Benzylideneamino]-3,5-bis(2,2,2-trifluoroethyl)-1,3,5-triazinane-2,4,6-trione [ACD/IUPAC Name]
1-[(E)-Benzylidèneamino]-3,5-bis(2,2,2-trifluoroéthyl)-1,3,5-triazinane-2,4,6-trione [French] [ACD/IUPAC Name]
1-[(phenylmethylidene)amino]-3,5-bis(2,2,2-trifluoroethyl)-1,3,5-triazinane-2,4,6-trione
1807939-00-9 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 370.9±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.8±3.0 kJ/mol
Flash Point: 178.1±30.7 °C
Index of Refraction: 1.530
Molar Refractivity: 79.7±0.5 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.78
ACD/LogD (pH 5.5): 2.48
ACD/BCF (pH 5.5): 45.49
ACD/KOC (pH 5.5): 534.97
ACD/LogD (pH 7.4): 2.48
ACD/BCF (pH 7.4): 45.49
ACD/KOC (pH 7.4): 534.97
Polar Surface Area: 73 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 41.6±7.0 dyne/cm
Molar Volume: 258.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement