ChemSpider 2D Image | 4-[2-({4-[Butyl(methyl)amino]-6-[(3-fluoro-4-methylphenyl)amino]-1,3,5-triazin-2-yl}amino)-1-(dimethylamino)ethyl]phenol | C25H34FN7O

4-[2-({4-[Butyl(methyl)amino]-6-[(3-fluoro-4-methylphenyl)amino]-1,3,5-triazin-2-yl}amino)-1-(dimethylamino)ethyl]phenol

  • Molecular FormulaC25H34FN7O
  • Average mass467.582 Da
  • Monoisotopic mass467.280884 Da
  • ChemSpider ID124583211

More details:

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

4-[2-({4-[Butyl(methyl)amino]-6-[(3-fluor-4-methylphenyl)amino]-1,3,5-triazin-2-yl}amino)-1-(dimethylamino)ethyl]phenol [German] [ACD/IUPAC Name]
4-[2-({4-[Butyl(methyl)amino]-6-[(3-fluoro-4-methylphenyl)amino]-1,3,5-triazin-2-yl}amino)-1-(dimethylamino)ethyl]phenol [ACD/IUPAC Name]
4-[2-({4-[Butyl(méthyl)amino]-6-[(3-fluoro-4-méthylphényl)amino]-1,3,5-triazin-2-yl}amino)-1-(diméthylamino)éthyl]phénol [French] [ACD/IUPAC Name]
Phenol, 4-[2-[[4-(butylmethylamino)-6-[(3-fluoro-4-methylphenyl)amino]-1,3,5-triazin-2-yl]amino]-1-(dimethylamino)ethyl]- [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: 624.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.8±3.0 kJ/mol
Flash Point: 331.2±34.3 °C
Index of Refraction: 1.639
Molar Refractivity: 136.5±0.3 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 0
ACD/LogP: 4.11
ACD/LogD (pH 5.5): 1.62
ACD/BCF (pH 5.5): 2.26
ACD/KOC (pH 5.5): 10.68
ACD/LogD (pH 7.4): 3.41
ACD/BCF (pH 7.4): 139.55
ACD/KOC (pH 7.4): 658.34
Polar Surface Area: 89 Å2
Polarizability: 54.1±0.5 10-24cm3
Surface Tension: 56.3±3.0 dyne/cm
Molar Volume: 379.3±3.0 cm3

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