ChemSpider 2D Image | 3-[Bis(2-hydroxyethyl)amino]-5-(trifluoromethyl)-2-pyridinecarbonitrile | C11H12F3N3O2

3-[Bis(2-hydroxyethyl)amino]-5-(trifluoromethyl)-2-pyridinecarbonitrile

  • Molecular FormulaC11H12F3N3O2
  • Average mass275.227 Da
  • Monoisotopic mass275.088165 Da
  • ChemSpider ID32057086

More details:






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

2-Pyridinecarbonitrile, 3-[bis(2-hydroxyethyl)amino]-5-(trifluoromethyl)- [ACD/Index Name]
3-[Bis(2-hydroxyethyl)amino]-5-(trifluormethyl)-2-pyridincarbonitril [German] [ACD/IUPAC Name]
3-[Bis(2-hydroxyethyl)amino]-5-(trifluoromethyl)-2-pyridinecarbonitrile [ACD/IUPAC Name]
3-[Bis(2-hydroxyéthyl)amino]-5-(trifluorométhyl)-2-pyridinecarbonitrile [French] [ACD/IUPAC Name]
1672655-86-5 [RN]
3-(bis(2-hydroxyethyl)amino)-5-(trifluoromethyl)picolinonitrile
3-[Bis(2-hydroxyethyl)amino]-2-cyano-5-(trifluoromethyl)pyridine
3-[bis(2-hydroxyethyl)amino]-5-(trifluoromethyl)pyridine-2-carbonitrile
51362-37-9 [RN]
CS-10529
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 470.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.2±3.0 kJ/mol
Flash Point: 238.2±28.7 °C
Index of Refraction: 1.534
Molar Refractivity: 59.6±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.00
ACD/LogD (pH 5.5): 0.64
ACD/BCF (pH 5.5): 1.79
ACD/KOC (pH 5.5): 52.82
ACD/LogD (pH 7.4): 0.64
ACD/BCF (pH 7.4): 1.79
ACD/KOC (pH 7.4): 52.82
Polar Surface Area: 80 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 58.1±5.0 dyne/cm
Molar Volume: 191.8±5.0 cm3

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