ChemSpider 2D Image | 2,2'-({4-[(3,4-Difluorophenyl)amino]-6-[(3-pyridinylmethyl)amino]-1,3,5-triazin-2-yl}imino)diethanol | C19H21F2N7O2

2,2'-({4-[(3,4-Difluorophenyl)amino]-6-[(3-pyridinylmethyl)amino]-1,3,5-triazin-2-yl}imino)diethanol

  • Molecular FormulaC19H21F2N7O2
  • Average mass417.413 Da
  • Monoisotopic mass417.172485 Da
  • ChemSpider ID124711247

More details:

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

2,2'-({4-[(3,4-Difluorophenyl)amino]-6-[(3-pyridinylmethyl)amino]-1,3,5-triazin-2-yl}imino)diethanol [ACD/IUPAC Name]
2,2'-({4-[(3,4-Difluorophényl)amino]-6-[(3-pyridinylméthyl)amino]-1,3,5-triazin-2-yl}imino)diéthanol [French] [ACD/IUPAC Name]
2,2'-({4-[(3,4-Difluorphenyl)amino]-6-[(3-pyridinylmethyl)amino]-1,3,5-triazin-2-yl}imino)diethanol [German] [ACD/IUPAC Name]
Ethanol, 2,2'-[[4-[(3,4-difluorophenyl)amino]-6-[(3-pyridinylmethyl)amino]-1,3,5-triazin-2-yl]imino]bis- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 670.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.6±3.0 kJ/mol
Flash Point: 359.6±34.3 °C
Index of Refraction: 1.695
Molar Refractivity: 108.7±0.3 cm3
#H bond acceptors: 9
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 0.03
ACD/LogD (pH 5.5): 1.29
ACD/BCF (pH 5.5): 5.31
ACD/KOC (pH 5.5): 106.83
ACD/LogD (pH 7.4): 1.40
ACD/BCF (pH 7.4): 6.82
ACD/KOC (pH 7.4): 137.35
Polar Surface Area: 119 Å2
Polarizability: 43.1±0.5 10-24cm3
Surface Tension: 76.8±3.0 dyne/cm
Molar Volume: 283.0±3.0 cm3

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