ChemSpider 2D Image | 3-[(Z)-Phenyldiazenyl]-2,4-pentanedione | C11H12N2O2

3-[(Z)-Phenyldiazenyl]-2,4-pentanedione

  • Molecular FormulaC11H12N2O2
  • Average mass204.225 Da
  • Monoisotopic mass204.089874 Da
  • ChemSpider ID32777063
  • Double-bond stereo - Double-bond stereo


More details:






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

2,4-Pentanedione, 3-[(Z)-2-phenyldiazenyl]- [ACD/Index Name]
3-[(Z)-Phenyldiazenyl]-2,4-pentandion [German] [ACD/IUPAC Name]
3-[(Z)-Phenyldiazenyl]-2,4-pentanedione [ACD/IUPAC Name]
3-[(Z)-Phényldiazényl]-2,4-pentanedione [French] [ACD/IUPAC Name]
56276-49-4 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 269.2±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 50.7±3.0 kJ/mol
Flash Point: 107.9±29.9 °C
Index of Refraction: 1.547
Molar Refractivity: 58.1±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.17
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 56.91
ACD/KOC (pH 5.5): 622.63
ACD/LogD (pH 7.4): 2.09
ACD/BCF (pH 7.4): 17.03
ACD/KOC (pH 7.4): 186.36
Polar Surface Area: 59 Å2
Polarizability: 23.0±0.5 10-24cm3
Surface Tension: 39.6±7.0 dyne/cm
Molar Volume: 183.4±7.0 cm3

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