ChemSpider 2D Image | 2-(3-Pyridinylmethyl)benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetrone | C20H11N3O4

2-(3-Pyridinylmethyl)benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetrone

  • Molecular FormulaC20H11N3O4
  • Average mass357.319 Da
  • Monoisotopic mass357.074951 Da
  • ChemSpider ID64840340

More details:

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

2-(3-Pyridinylmethyl)benzo[lmn][3,8]phenanthrolin-1,3,6,8(2H,7H)-tetron [German] [ACD/IUPAC Name]
2-(3-Pyridinylmethyl)benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetrone [ACD/IUPAC Name]
2-(3-Pyridinylméthyl)benzo[lmn][3,8]phénanthroline-1,3,6,8(2H,7H)-tétrone [French] [ACD/IUPAC Name]
Benzo[lmn][3,8]phenanthroline-1,3,6,8(2H,7H)-tetrone, 2-(3-pyridinylmethyl)- [ACD/Index Name]
2-(pyridin-3-ylmethyl)benzo[lmn]-3,8-phenanthroline-1,3,6,8(2H,7H)-tetrone

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

Density: 1.6±0.1 g/cm3
Boiling Point: 703.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.9±3.0 kJ/mol
Flash Point: 379.1±32.9 °C
Index of Refraction: 1.768
Molar Refractivity: 93.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: -1.80
ACD/LogD (pH 5.5): 0.72
ACD/BCF (pH 5.5): 2.02
ACD/KOC (pH 5.5): 55.44
ACD/LogD (pH 7.4): 0.77
ACD/BCF (pH 7.4): 2.23
ACD/KOC (pH 7.4): 61.22
Polar Surface Area: 96 Å2
Polarizability: 37.2±0.5 10-24cm3
Surface Tension: 85.9±3.0 dyne/cm
Molar Volume: 226.3±3.0 cm3

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