ChemSpider 2D Image | 2-[(E)-{[4,6-Di(1-azepanyl)-1,3,5-triazin-2-yl]hydrazono}methyl]phenol | C22H31N7O

2-[(E)-{[4,6-Di(1-azepanyl)-1,3,5-triazin-2-yl]hydrazono}methyl]phenol

  • Molecular FormulaC22H31N7O
  • Average mass409.528 Da
  • Monoisotopic mass409.259003 Da
  • ChemSpider ID21537909

  • Double-bond stereo - Double-bond stereo

More details:

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

2-[(E)-{[4,6-Di(1-azepanyl)-1,3,5-triazin-2-yl]hydrazono}methyl]phenol [ACD/IUPAC Name]
2-[(E)-{[4,6-Di(1-azepanyl)-1,3,5-triazin-2-yl]hydrazono}methyl]phenol [German] [ACD/IUPAC Name]
2-[(E)-{[4,6-Di(1-azépanyl)-1,3,5-triazin-2-yl]hydrazono}méthyl]phénol [French] [ACD/IUPAC Name]
Benzaldehyde, 2-hydroxy-, 2-[4,6-bis(hexahydro-1H-azepin-1-yl)-1,3,5-triazin-2-yl]hydrazone [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 624.9±57.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.9±3.0 kJ/mol
Flash Point: 331.7±32.1 °C
Index of Refraction: 1.671
Molar Refractivity: 117.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.09
ACD/LogD (pH 5.5): 1.83
ACD/BCF (pH 5.5): 5.68
ACD/KOC (pH 5.5): 39.60
ACD/LogD (pH 7.4): 3.28
ACD/BCF (pH 7.4): 158.38
ACD/KOC (pH 7.4): 1103.24
Polar Surface Area: 90 Å2
Polarizability: 46.7±0.5 10-24cm3
Surface Tension: 55.0±7.0 dyne/cm
Molar Volume: 314.9±7.0 cm3

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