ChemSpider 2D Image | 2,2'-[{6-[4-(2-Pyrimidinyl)-1-piperazinyl]-1,3,5-triazine-2,4-diyl}bis(imino-2,1-ethanediyloxy)]diethanol | C19H31N9O4

2,2'-[{6-[4-(2-Pyrimidinyl)-1-piperazinyl]-1,3,5-triazine-2,4-diyl}bis(imino-2,1-ethanediyloxy)]diethanol

  • Molecular FormulaC19H31N9O4
  • Average mass449.507 Da
  • Monoisotopic mass449.249908 Da
  • ChemSpider ID124521754

More details:

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

2,2'-[{6-[4-(2-Pyrimidinyl)-1-piperazinyl]-1,3,5-triazin-2,4-diyl}bis(imino-2,1-ethandiyloxy)]diethanol [German] [ACD/IUPAC Name]
2,2'-[{6-[4-(2-Pyrimidinyl)-1-piperazinyl]-1,3,5-triazine-2,4-diyl}bis(imino-2,1-ethanediyloxy)]diethanol [ACD/IUPAC Name]
2,2'-[{6-[4-(2-Pyrimidinyl)-1-pipérazinyl]-1,3,5-triazine-2,4-diyl}bis(imino-2,1-éthanediyloxy)]diéthanol [French] [ACD/IUPAC Name]
Ethanol, 2,2'-[[6-[4-(2-pyrimidinyl)-1-piperazinyl]-1,3,5-triazine-2,4-diyl]bis(imino-2,1-ethanediyloxy)]bis- [ACD/Index 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: 738.1±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.0±3.0 kJ/mol
Flash Point: 400.2±35.7 °C
Index of Refraction: 1.640
Molar Refractivity: 118.5±0.3 cm3
#H bond acceptors: 13
#H bond donors: 4
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: -2.61
ACD/LogD (pH 5.5): -1.91
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.83
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.89
Polar Surface Area: 154 Å2
Polarizability: 47.0±0.5 10-24cm3
Surface Tension: 81.2±3.0 dyne/cm
Molar Volume: 328.8±3.0 cm3

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