ChemSpider 2D Image | 4-Amino-2,4-cyclohexadien-1-one | C6H7NO

4-Amino-2,4-cyclohexadien-1-one

  • Molecular FormulaC6H7NO
  • Average mass109.126 Da
  • Monoisotopic mass109.052765 Da
  • ChemSpider ID26995134

More details:

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

2,4-Cyclohexadien-1-one, 4-amino- [ACD/Index Name]
4-Amino-2,4-cyclohexadien-1-on [German] [ACD/IUPAC Name]
4-Amino-2,4-cyclohexadien-1-one [ACD/IUPAC Name]
4-Amino-2,4-cyclohexadién-1-one [French] [ACD/IUPAC Name]
4-aminocyclohexadienone

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

Density: 1.1±0.1 g/cm3
Boiling Point: 226.5±30.0 °C at 760 mmHg
Vapour Pressure: 0.1±0.4 mmHg at 25°C
Enthalpy of Vaporization: 46.3±3.0 kJ/mol
Flash Point: 90.8±24.6 °C
Index of Refraction: 1.556
Molar Refractivity: 30.6±0.3 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -1.08
ACD/LogD (pH 5.5): -0.82
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.55
ACD/LogD (pH 7.4): -0.70
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 9.93
Polar Surface Area: 43 Å2
Polarizability: 12.1±0.5 10-24cm3
Surface Tension: 45.6±3.0 dyne/cm
Molar Volume: 95.1±3.0 cm3

Click to predict properties on the Chemicalize site


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