ChemSpider 2D Image | 6-Hydroxy-1,4-cycloheptanedione | C7H10O3

6-Hydroxy-1,4-cycloheptanedione

  • Molecular FormulaC7H10O3
  • Average mass142.152 Da
  • Monoisotopic mass142.062988 Da
  • ChemSpider ID35802604

More details:






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

1,4-Cycloheptanedione, 6-hydroxy- [ACD/Index Name]
6-Hydroxy-1,4-cycloheptandion [German] [ACD/IUPAC Name]
6-Hydroxy-1,4-cycloheptanedione [ACD/IUPAC Name]
6-Hydroxy-1,4-cycloheptanedione [French] [ACD/IUPAC Name]
1,4-Cycloheptanedione,6-hydroxy-
150044-67-0 [RN]
6-HYDROXYCYCLOHEPTA-1,4-DIONE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 317.0±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 64.7±6.0 kJ/mol
Flash Point: 159.7±24.4 °C
Index of Refraction: 1.510
Molar Refractivity: 34.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 0
#Rule of 5 Violations: 0
ACD/LogP: -1.62
ACD/LogD (pH 5.5): -1.15
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 5.67
ACD/LogD (pH 7.4): -1.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.67
Polar Surface Area: 54 Å2
Polarizability: 13.5±0.5 10-24cm3
Surface Tension: 51.6±3.0 dyne/cm
Molar Volume: 114.2±3.0 cm3

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