ChemSpider 2D Image | 2-(4-Chlorophenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene | C22H19ClN2

2-(4-Chlorophenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene

  • Molecular FormulaC22H19ClN2
  • Average mass346.853 Da
  • Monoisotopic mass346.123688 Da
  • ChemSpider ID21481036

More details:

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

2-(4-Chlorophenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene [ACD/IUPAC Name]
2-(4-Chlorophényl)-4-phényl-5,6,7,8-tétrahydro-2a,4a-diazacyclopenta[cd]azulène [French] [ACD/IUPAC Name]
2-(4-Chlorphenyl)-4-phenyl-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulen [German] [ACD/IUPAC Name]
2a,4a-Diazacyclopent[cd]azulene, 2-(4-chlorophenyl)-5,6,7,8-tetrahydro-4-phenyl- [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.678
Molar Refractivity: 103.7±0.5 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 1
ACD/LogP: 7.11
ACD/LogD (pH 5.5): 5.79
ACD/BCF (pH 5.5): 14708.98
ACD/KOC (pH 5.5): 33476.73
ACD/LogD (pH 7.4): 5.79
ACD/BCF (pH 7.4): 14708.98
ACD/KOC (pH 7.4): 33476.73
Polar Surface Area: 9 Å2
Polarizability: 41.1±0.5 10-24cm3
Surface Tension: 48.8±7.0 dyne/cm
Molar Volume: 275.0±7.0 cm3

Click to predict properties on the Chemicalize site


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