ChemSpider 2D Image | 4-Methyl-2-(3-oxo-3-phenylpropanoyl)phenolate | C16H13O3

4-Methyl-2-(3-oxo-3-phenylpropanoyl)phenolate

  • Molecular FormulaC16H13O3
  • Average mass253.273 Da
  • Monoisotopic mass253.087021 Da
  • ChemSpider ID95727533

  • Charge - Charge

More details:

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

1,3-Propanedione, 1-(2-hydroxy-5-methylphenyl)-3-phenyl-, ion(1-) [ACD/Index Name]
4-Methyl-2-(3-oxo-3-phenylpropanoyl)phenolat [German] [ACD/IUPAC Name]
4-Methyl-2-(3-oxo-3-phenylpropanoyl)phenolate [ACD/IUPAC Name]
4-Méthyl-2-(3-oxo-3-phénylpropanoyl)phénolate [French] [ACD/IUPAC Name]

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

Density:
Boiling Point: 437.3±35.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.1±3.0 kJ/mol
Flash Point: 232.4±22.4 °C
Index of Refraction:
Molar Refractivity:
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.80
ACD/LogD (pH 5.5): 3.64
ACD/BCF (pH 5.5): 346.96
ACD/KOC (pH 5.5): 2289.71
ACD/LogD (pH 7.4): 3.60
ACD/BCF (pH 7.4): 315.18
ACD/KOC (pH 7.4): 2079.96
Polar Surface Area: 57 Å2
Polarizability:
Surface Tension:
Molar Volume:

Click to predict properties on the Chemicalize site


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