ChemSpider 2D Image | 5-Chloro-6-hydroxy-7,8-dimethyl-2-chromanone | C11H11ClO3

5-Chloro-6-hydroxy-7,8-dimethyl-2-chromanone

  • Molecular FormulaC11H11ClO3
  • Average mass226.656 Da
  • Monoisotopic mass226.039673 Da
  • ChemSpider ID30656862

More details:

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

2H-1-Benzopyran-2-one, 5-chloro-3,4-dihydro-6-hydroxy-7,8-dimethyl- [ACD/Index Name]
5-Chlor-6-hydroxy-7,8-dimethyl-2-chromanon [German] [ACD/IUPAC Name]
5-Chloro-6-hydroxy-7,8-dimethyl-2-chromanone [ACD/IUPAC Name]
5-Chloro-6-hydroxy-7,8-diméthyl-2-chromanone [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 403.4±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 68.0±3.0 kJ/mol
Flash Point: 197.8±28.7 °C
Index of Refraction: 1.594
Molar Refractivity: 56.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: 2.63
ACD/LogD (pH 5.5): 2.62
ACD/BCF (pH 5.5): 57.62
ACD/KOC (pH 5.5): 633.45
ACD/LogD (pH 7.4): 2.59
ACD/BCF (pH 7.4): 53.55
ACD/KOC (pH 7.4): 588.74
Polar Surface Area: 47 Å2
Polarizability: 22.4±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 166.7±3.0 cm3

Click to predict properties on the Chemicalize site


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