ChemSpider 2D Image | 4-(5-Methyl-4-Phenylisoxazol-3-Yl)benzene-1,3-Diol | C16H13NO3

4-(5-Methyl-4-Phenylisoxazol-3-Yl)benzene-1,3-Diol

  • Molecular FormulaC16H13NO3
  • Average mass267.279 Da
  • Monoisotopic mass267.089539 Da
  • ChemSpider ID26329418

More details:

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

1,3-Benzenediol, 4-(5-methyl-4-phenyl-3-isoxazolyl)- [ACD/Index Name]
4-(5-Methyl-4-phenyl-1,2-oxazol-3-yl)-1,3-benzenediol [ACD/IUPAC Name]
4-(5-Méthyl-4-phényl-1,2-oxazol-3-yl)-1,3-benzènediol [French] [ACD/IUPAC Name]
4-(5-Methyl-4-phenyl-1,2-oxazol-3-yl)-1,3-benzoldiol [German] [ACD/IUPAC Name]
4-(5-Methyl-4-Phenylisoxazol-3-Yl)benzene-1,3-Diol
YJW

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

Density: 1.3±0.1 g/cm3
Boiling Point: 438.6±24.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.2±3.0 kJ/mol
Flash Point: 219.0±22.9 °C
Index of Refraction: 1.630
Molar Refractivity: 74.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.64
ACD/LogD (pH 5.5): 2.55
ACD/BCF (pH 5.5): 51.11
ACD/KOC (pH 5.5): 580.97
ACD/LogD (pH 7.4): 2.45
ACD/BCF (pH 7.4): 40.23
ACD/KOC (pH 7.4): 457.30
Polar Surface Area: 66 Å2
Polarizability: 29.5±0.5 10-24cm3
Surface Tension: 55.1±3.0 dyne/cm
Molar Volume: 209.2±3.0 cm3

Click to predict properties on the Chemicalize site


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