ChemSpider 2D Image | 5,7-Dihydroxy-8-methyl-4-oxo-2-phenyl-4H-chromene-6-carbaldehyde | C17H12O5

5,7-Dihydroxy-8-methyl-4-oxo-2-phenyl-4H-chromene-6-carbaldehyde

  • Molecular FormulaC17H12O5
  • Average mass296.274 Da
  • Monoisotopic mass296.068481 Da
  • ChemSpider ID23146519

More details:

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

4H-1-Benzopyran-6-carboxaldehyde, 5,7-dihydroxy-8-methyl-4-oxo-2-phenyl- [ACD/Index Name]
5,7-Dihydroxy-8-methyl-4-oxo-2-phenyl-4H-chromen-6-carbaldehyd [German] [ACD/IUPAC Name]
5,7-Dihydroxy-8-methyl-4-oxo-2-phenyl-4H-chromene-6-carbaldehyde [ACD/IUPAC Name]
5,7-Dihydroxy-8-méthyl-4-oxo-2-phényl-4H-chromène-6-carbaldéhyde [French] [ACD/IUPAC Name]
59677-74-6 [RN]
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL300489/
Unonal

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

Density: 1.5±0.1 g/cm3
Boiling Point: 509.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.0±3.0 kJ/mol
Flash Point: 192.2±23.6 °C
Index of Refraction: 1.708
Molar Refractivity: 79.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 4.17
ACD/LogD (pH 5.5): 3.46
ACD/BCF (pH 5.5): 164.83
ACD/KOC (pH 5.5): 810.56
ACD/LogD (pH 7.4): 0.86
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.01
Polar Surface Area: 84 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 70.6±3.0 dyne/cm
Molar Volume: 204.1±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement