ChemSpider 2D Image | N~2~,N~2~-Dibenzyl-N~4~-isobutyl-N~6~-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine | C28H29F3N6

N2,N2-Dibenzyl-N4-isobutyl-N6-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine

  • Molecular FormulaC28H29F3N6
  • Average mass506.565 Da
  • Monoisotopic mass506.240570 Da
  • ChemSpider ID124501446

More details:

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

1,3,5-Triazine-2,4,6-triamine, N4-(2-methylpropyl)-N2,N2-bis(phenylmethyl)-N6-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
N2,N2-Dibenzyl-N4-isobutyl-N6-[3-(trifluormethyl)phenyl]-1,3,5-triazin-2,4,6-triamin [German] [ACD/IUPAC Name]
N2,N2-Dibenzyl-N4-isobutyl-N6-[3-(trifluoromethyl)phenyl]-1,3,5-triazine-2,4,6-triamine [ACD/IUPAC Name]
N2,N2-Dibenzyl-N4-isobutyl-N6-[3-(trifluorométhyl)phényl]-1,3,5-triazine-2,4,6-triamine [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 636.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.0±3.0 kJ/mol
Flash Point: 338.6±34.3 °C
Index of Refraction: 1.631
Molar Refractivity: 141.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 6.42
ACD/LogD (pH 5.5): 6.24
ACD/BCF (pH 5.5): 29680.63
ACD/KOC (pH 5.5): 50131.14
ACD/LogD (pH 7.4): 6.38
ACD/BCF (pH 7.4): 41788.48
ACD/KOC (pH 7.4): 70581.52
Polar Surface Area: 66 Å2
Polarizability: 56.1±0.5 10-24cm3
Surface Tension: 51.0±3.0 dyne/cm
Molar Volume: 397.4±3.0 cm3

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