ChemSpider 2D Image | 4-[(1E)-3-(3-Hydroxyphenyl)-3-oxo-1-propen-1-yl]benzoic acid | C16H12O4

4-[(1E)-3-(3-Hydroxyphenyl)-3-oxo-1-propen-1-yl]benzoic acid

  • Molecular FormulaC16H12O4
  • Average mass268.264 Da
  • Monoisotopic mass268.073547 Da
  • ChemSpider ID68179977

More details:

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

4-[(1E)-3-(3-Hydroxyphenyl)-3-oxo-1-propen-1-yl]benzoesäure [German] [ACD/IUPAC Name]
4-[(1E)-3-(3-Hydroxyphenyl)-3-oxo-1-propen-1-yl]benzoic acid [ACD/IUPAC Name]
Acide 4-[(1E)-3-(3-hydroxyphényl)-3-oxo-1-propén-1-yl]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-[(1E)-3-(3-hydroxyphenyl)-3-oxo-1-propen-1-yl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 536.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 85.6±3.0 kJ/mol
Flash Point: 292.2±26.6 °C
Index of Refraction: 1.681
Molar Refractivity: 75.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.84
ACD/LogD (pH 5.5): 1.69
ACD/BCF (pH 5.5): 5.16
ACD/KOC (pH 5.5): 44.67
ACD/LogD (pH 7.4): 0.17
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.36
Polar Surface Area: 75 Å2
Polarizability: 30.1±0.5 10-24cm3
Surface Tension: 64.1±3.0 dyne/cm
Molar Volume: 200.8±3.0 cm3

Click to predict properties on the Chemicalize site


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