ChemSpider 2D Image | 2-Azatricyclo[6.2.0.0~3,6~]deca-1,3,5,7,9-pentaene | C9H5N

2-Azatricyclo[6.2.0.03,6]deca-1,3,5,7,9-pentaene

  • Molecular FormulaC9H5N
  • Average mass127.143 Da
  • Monoisotopic mass127.042198 Da
  • ChemSpider ID24184783

More details:

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

2-Azatricyclo[6.2.0.03,6]deca-1,3,5,7,9-pentaen [German] [ACD/IUPAC Name]
2-Azatricyclo[6.2.0.03,6]deca-1,3,5,7,9-pentaene [ACD/Index Name] [ACD/IUPAC Name]
2-Azatricyclo[6.2.0.03,6]déca-1,3,5,7,9-pentaène [French] [ACD/IUPAC Name]
2-azatricyclo[6.2.0.03,6]deca-1,3,5,7,9-pentaene
2-Azatricyclo[6.2.0.03,6]deca-1,3,5,7,9-pentaene (9CI)
441798-65-8 [RN]
MFCD28044900

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

Density: 1.3±0.1 g/cm3
Boiling Point: 424.9±18.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 65.3±3.0 kJ/mol
Flash Point: 203.4±22.1 °C
Index of Refraction: 1.754
Molar Refractivity: 39.4±0.5 cm3
#H bond acceptors: 1
#H bond donors: 0
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -0.16
ACD/LogD (pH 5.5): -1.06
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.38
ACD/LogD (pH 7.4): 0.23
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 26.58
Polar Surface Area: 12 Å2
Polarizability: 15.6±0.5 10-24cm3
Surface Tension: 50.7±7.0 dyne/cm
Molar Volume: 96.4±7.0 cm3

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