ChemSpider 2D Image | 4-Methyl-3-nitro-2H,6H-pyrano[3,2-g]chromene-2,6-dione | C13H7NO6

4-Methyl-3-nitro-2H,6H-pyrano[3,2-g]chromene-2,6-dione

  • Molecular FormulaC13H7NO6
  • Average mass273.198 Da
  • Monoisotopic mass273.027344 Da
  • ChemSpider ID316926

More details:

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

2H,6H-Benzo[1,2-b:5,4-b']dipyran-2,6-dione, 4-methyl-3-nitro- [ACD/Index Name]
4-Methyl-3-nitro-2H,6H-pyrano[3,2-g]chromen-2,6-dion [German] [ACD/IUPAC Name]
4-Methyl-3-nitro-2H,6H-pyrano[3,2-g]chromene-2,6-dione [ACD/IUPAC Name]
4-Méthyl-3-nitro-2H,6H-pyrano[3,2-g]chromène-2,6-dione [French] [ACD/IUPAC Name]

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

AIDS130823 [DBID]
AIDS-130823 [DBID]
NSC614576 [DBID]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 494.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.2±3.0 kJ/mol
Flash Point: 241.2±30.7 °C
Index of Refraction: 1.674
Molar Refractivity: 64.2±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 1.09
ACD/LogD (pH 5.5): 1.91
ACD/BCF (pH 5.5): 16.63
ACD/KOC (pH 5.5): 260.38
ACD/LogD (pH 7.4): 1.91
ACD/BCF (pH 7.4): 16.63
ACD/KOC (pH 7.4): 260.38
Polar Surface Area: 98 Å2
Polarizability: 25.4±0.5 10-24cm3
Surface Tension: 71.5±5.0 dyne/cm
Molar Volume: 171.0±5.0 cm3

Predicted data is generated using the US Environmental Protection Agency�s EPISuite™

Click to predict properties on the Chemicalize site


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