ChemSpider 2D Image | 4-[(E)-2-(5-Nitro-2-furyl)vinyl]benzoate | C13H8NO5

4-[(E)-2-(5-Nitro-2-furyl)vinyl]benzoate

  • Molecular FormulaC13H8NO5
  • Average mass258.207 Da
  • Monoisotopic mass258.040802 Da
  • ChemSpider ID21258661

  • Charge - Charge

    Double-bond stereo - Double-bond stereo

More details:

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

4-[(E)-2-(5-Nitro-2-furyl)vinyl]benzoat [German] [ACD/IUPAC Name]
4-[(E)-2-(5-Nitro-2-furyl)vinyl]benzoate [ACD/IUPAC Name]
4-[(E)-2-(5-Nitro-2-furyl)vinyl]benzoate [French] [ACD/IUPAC Name]
Benzoic acid, 4-[(E)-2-(5-nitro-2-furanyl)ethenyl]-, ion(1-) [ACD/Index Name]

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

Density:
Boiling Point: 454.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.2±3.0 kJ/mol
Flash Point: 228.6±28.7 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.51
ACD/LogD (pH 5.5): 2.35
ACD/BCF (pH 5.5): 17.23
ACD/KOC (pH 5.5): 111.77
ACD/LogD (pH 7.4): 0.80
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.15
Polar Surface Area: 99 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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