ChemSpider 2D Image | 1-Formyl-2-azulenecarbonitrile | C12H7NO

1-Formyl-2-azulenecarbonitrile

  • Molecular FormulaC12H7NO
  • Average mass181.190 Da
  • Monoisotopic mass181.052765 Da
  • ChemSpider ID60820776

More details:

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

1-Formyl-2-azulencarbonitril [German] [ACD/IUPAC Name]
1-Formyl-2-azulenecarbonitrile [ACD/IUPAC Name]
1-Formyl-2-azulènecarbonitrile [French] [ACD/IUPAC Name]
2-Azulenecarbonitrile, 1-formyl- [ACD/Index Name]
91353-82-1 [RN]
MFCD24680046

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

Density: 1.2±0.1 g/cm3
Boiling Point: 396.9±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.7±3.0 kJ/mol
Flash Point: 193.9±23.2 °C
Index of Refraction: 1.650
Molar Refractivity: 53.8±0.4 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.68
ACD/LogD (pH 5.5): 2.46
ACD/BCF (pH 5.5): 43.48
ACD/KOC (pH 5.5): 517.93
ACD/LogD (pH 7.4): 2.46
ACD/BCF (pH 7.4): 43.48
ACD/KOC (pH 7.4): 517.93
Polar Surface Area: 41 Å2
Polarizability: 21.3±0.5 10-24cm3
Surface Tension: 56.7±5.0 dyne/cm
Molar Volume: 147.6±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement