ChemSpider 2D Image | 8-Acetyl-6-hydroxy-7-methoxycoumarin | C12H10O5

8-Acetyl-6-hydroxy-7-methoxycoumarin

  • Molecular FormulaC12H10O5
  • Average mass234.205 Da
  • Monoisotopic mass234.052826 Da
  • ChemSpider ID21486205

More details:

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

2H-1-Benzopyran-2-one, 8-acetyl-6-hydroxy-7-methoxy- [ACD/Index Name]
8-Acetyl-6-hydroxy-7-methoxy-2H-1-benzopyran-2-one
8-Acetyl-6-hydroxy-7-methoxy-2H-chromen-2-on [German] [ACD/IUPAC Name]
8-Acetyl-6-hydroxy-7-methoxy-2H-chromen-2-one [ACD/IUPAC Name]
8-Acétyl-6-hydroxy-7-méthoxy-2H-chromén-2-one [French] [ACD/IUPAC Name]
8-Acetyl-6-hydroxy-7-methoxycoumarin
T66 BOVJ HQ IO1 JV1 [WLN]
202288-19-5 [RN]
8-ACETYL-6-HYDROXY-7-METHOXY-CHROMEN-2-ONE
MFCD00270163

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

Density: 1.4±0.1 g/cm3
Boiling Point: 489.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.5±3.0 kJ/mol
Flash Point: 196.3±22.2 °C
Index of Refraction: 1.598
Molar Refractivity: 58.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 0.85
ACD/LogD (pH 5.5): 1.13
ACD/BCF (pH 5.5): 4.25
ACD/KOC (pH 5.5): 97.99
ACD/LogD (pH 7.4): 1.06
ACD/BCF (pH 7.4): 3.59
ACD/KOC (pH 7.4): 82.76
Polar Surface Area: 73 Å2
Polarizability: 23.1±0.5 10-24cm3
Surface Tension: 53.7±3.0 dyne/cm
Molar Volume: 171.1±3.0 cm3

Click to predict properties on the Chemicalize site


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