ChemSpider 2D Image | 3-(4-Chlorophenyl)-5,7-dihydroxy-2-methyl-4H-chromen-4-one | C16H11ClO4

3-(4-Chlorophenyl)-5,7-dihydroxy-2-methyl-4H-chromen-4-one

  • Molecular FormulaC16H11ClO4
  • Average mass302.709 Da
  • Monoisotopic mass302.034576 Da
  • ChemSpider ID28823937

More details:

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

3-(4-Chlorophenyl)-5,7-dihydroxy-2-methyl-4H-chromen-4-one [ACD/IUPAC Name]
3-(4-Chlorophényl)-5,7-dihydroxy-2-méthyl-4H-chromén-4-one [French] [ACD/IUPAC Name]
3-(4-Chlorphenyl)-5,7-dihydroxy-2-methyl-4H-chromen-4-on [German] [ACD/IUPAC Name]
4H-1-Benzopyran-4-one, 3-(4-chlorophenyl)-5,7-dihydroxy-2-methyl- [ACD/Index Name]
3-(4-chlorophenyl)-5,7-dihydroxy-2-methylchromen-4-one

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

Density: 1.5±0.1 g/cm3
Boiling Point: 511.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±3.0 kJ/mol
Flash Point: 263.0±30.1 °C
Index of Refraction: 1.677
Molar Refractivity: 77.6±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 4.50
ACD/LogD (pH 5.5): 4.41
ACD/BCF (pH 5.5): 1253.71
ACD/KOC (pH 5.5): 5435.65
ACD/LogD (pH 7.4): 3.08
ACD/BCF (pH 7.4): 59.66
ACD/KOC (pH 7.4): 258.66
Polar Surface Area: 67 Å2
Polarizability: 30.8±0.5 10-24cm3
Surface Tension: 62.6±3.0 dyne/cm
Molar Volume: 206.1±3.0 cm3

Click to predict properties on the Chemicalize site


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