ChemSpider 2D Image | 4-(3-Hydroxy-6-methoxy-4-oxo-4H-chromen-2-yl)benzoic acid | C17H12O6

4-(3-Hydroxy-6-methoxy-4-oxo-4H-chromen-2-yl)benzoic acid

  • Molecular FormulaC17H12O6
  • Average mass312.274 Da
  • Monoisotopic mass312.063385 Da
  • ChemSpider ID25954918

More details:

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

4-(3-Hydroxy-6-methoxy-4-oxo-4H-chromen-2-yl)benzoesäure [German] [ACD/IUPAC Name]
4-(3-Hydroxy-6-methoxy-4-oxo-4H-chromen-2-yl)benzoic acid [ACD/IUPAC Name]
Acide 4-(3-hydroxy-6-méthoxy-4-oxo-4H-chromén-2-yl)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-(3-hydroxy-6-methoxy-4-oxo-4H-1-benzopyran-2-yl)- [ACD/Index Name]
4-(3-Hydroxy-6-methoxy-4-oxo-4H-1-benzopyran-2-yl)benzoic acid
4-(3-HYDROXY-6-METHOXY-4-OXOCHROMEN-2-YL)BENZOIC ACID
663605-25-2 [RN]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 544.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 86.7±3.0 kJ/mol
Flash Point: 205.0±23.6 °C
Index of Refraction: 1.677
Molar Refractivity: 79.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.35
ACD/LogD (pH 5.5): 1.51
ACD/BCF (pH 5.5): 4.31
ACD/KOC (pH 5.5): 45.48
ACD/LogD (pH 7.4): -0.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.03
Polar Surface Area: 93 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 69.3±3.0 dyne/cm
Molar Volume: 210.8±3.0 cm3

Click to predict properties on the Chemicalize site


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