ChemSpider 2D Image | Methyl 4-nitro-1-benzofuran-2-carboxylate | C10H7NO5

Methyl 4-nitro-1-benzofuran-2-carboxylate

  • Molecular FormulaC10H7NO5
  • Average mass221.166 Da
  • Monoisotopic mass221.032425 Da
  • ChemSpider ID38775480

More details:

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

114382-07-9 [RN]
2-Benzofurancarboxylic acid, 4-nitro-, methyl ester [ACD/Index Name]
4-Nitro-1-benzofurane-2-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 4-nitro-1-benzofuran-2-carboxylate [ACD/IUPAC Name]
Methyl-4-nitro-1-benzofuran-2-carboxylat [German] [ACD/IUPAC Name]
Methyl 4-nitrobenzofuran-2-carboxylate

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

Density: 1.4±0.1 g/cm3
Boiling Point: 348.7±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 59.3±3.0 kJ/mol
Flash Point: 164.7±22.3 °C
Index of Refraction: 1.618
Molar Refractivity: 54.7±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.25
ACD/LogD (pH 5.5): 2.35
ACD/BCF (pH 5.5): 35.88
ACD/KOC (pH 5.5): 451.46
ACD/LogD (pH 7.4): 2.35
ACD/BCF (pH 7.4): 35.88
ACD/KOC (pH 7.4): 451.46
Polar Surface Area: 85 Å2
Polarizability: 21.7±0.5 10-24cm3
Surface Tension: 55.2±3.0 dyne/cm
Molar Volume: 156.1±3.0 cm3

Click to predict properties on the Chemicalize site


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