ChemSpider 2D Image | 5-({4-[Bis(2-hydroxyethyl)amino]-6-[(4-chloro-3-methylphenyl)amino]-1,3,5-triazin-2-yl}amino)-1-pentanol | C19H29ClN6O3

5-({4-[Bis(2-hydroxyethyl)amino]-6-[(4-chloro-3-methylphenyl)amino]-1,3,5-triazin-2-yl}amino)-1-pentanol

  • Molecular FormulaC19H29ClN6O3
  • Average mass424.925 Da
  • Monoisotopic mass424.198975 Da
  • ChemSpider ID124639480

More details:

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

1-Pentanol, 5-[[4-[bis(2-hydroxyethyl)amino]-6-[(4-chloro-3-methylphenyl)amino]-1,3,5-triazin-2-yl]amino]- [ACD/Index Name]
5-({4-[Bis(2-hydroxyethyl)amino]-6-[(4-chlor-3-methylphenyl)amino]-1,3,5-triazin-2-yl}amino)-1-pentanol [German] [ACD/IUPAC Name]
5-({4-[Bis(2-hydroxyethyl)amino]-6-[(4-chloro-3-methylphenyl)amino]-1,3,5-triazin-2-yl}amino)-1-pentanol [ACD/IUPAC Name]
5-({4-[Bis(2-hydroxyéthyl)amino]-6-[(4-chloro-3-méthylphényl)amino]-1,3,5-triazin-2-yl}amino)-1-pentanol [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 672.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.7±3.0 kJ/mol
Flash Point: 360.4±34.3 °C
Index of Refraction: 1.665
Molar Refractivity: 115.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 5
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 0.47
ACD/LogD (pH 5.5): 1.28
ACD/BCF (pH 5.5): 5.21
ACD/KOC (pH 5.5): 106.21
ACD/LogD (pH 7.4): 1.38
ACD/BCF (pH 7.4): 6.54
ACD/KOC (pH 7.4): 133.25
Polar Surface Area: 127 Å2
Polarizability: 46.0±0.5 10-24cm3
Surface Tension: 70.9±3.0 dyne/cm
Molar Volume: 312.4±3.0 cm3

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