ChemSpider 2D Image | (7-Hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)methyl (3-hydroxyadamantan-1-yl)acetate | C23H26O6

(7-Hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)methyl (3-hydroxyadamantan-1-yl)acetate

  • Molecular FormulaC23H26O6
  • Average mass398.449 Da
  • Monoisotopic mass398.172943 Da
  • ChemSpider ID22799139

More details:

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

(3-Hydroxyadamantan-1-yl)acétate de (7-hydroxy-8-méthyl-2-oxo-2H-chromén-4-yl)méthyle [French] [ACD/IUPAC Name]
(7-Hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)methyl (3-hydroxyadamantan-1-yl)acetate [ACD/IUPAC Name]
(7-Hydroxy-8-methyl-2-oxo-2H-chromen-4-yl)methyl-(3-hydroxyadamantan-1-yl)acetat [German] [ACD/IUPAC Name]
Tricyclo[3.3.1.13,7]decane-1-acetic acid, 3-hydroxy-, (7-hydroxy-8-methyl-2-oxo-2H-1-benzopyran-4-yl)methyl ester [ACD/Index 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: 596.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.4±3.0 kJ/mol
Flash Point: 208.1±23.6 °C
Index of Refraction: 1.637
Molar Refractivity: 103.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.96
ACD/LogD (pH 5.5): 3.50
ACD/BCF (pH 5.5): 268.80
ACD/KOC (pH 5.5): 1906.60
ACD/LogD (pH 7.4): 3.42
ACD/BCF (pH 7.4): 221.99
ACD/KOC (pH 7.4): 1574.56
Polar Surface Area: 93 Å2
Polarizability: 41.2±0.5 10-24cm3
Surface Tension: 64.2±3.0 dyne/cm
Molar Volume: 289.3±3.0 cm3

Click to predict properties on the Chemicalize site


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