ChemSpider 2D Image | (7-Methoxy-2-oxo-2H-chromen-4-yl)methyl 2-[(tetrahydro-2-furanylmethyl)sulfanyl]benzoate | C23H22O6S

(7-Methoxy-2-oxo-2H-chromen-4-yl)methyl 2-[(tetrahydro-2-furanylmethyl)sulfanyl]benzoate

  • Molecular FormulaC23H22O6S
  • Average mass426.482 Da
  • Monoisotopic mass426.113708 Da
  • ChemSpider ID30184082

More details:

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

(7-Methoxy-2-oxo-2H-chromen-4-yl)methyl 2-[(tetrahydro-2-furanylmethyl)sulfanyl]benzoate [ACD/IUPAC Name]
(7-Methoxy-2-oxo-2H-chromen-4-yl)methyl-2-[(tetrahydro-2-furanylmethyl)sulfanyl]benzoat [German] [ACD/IUPAC Name]
2-[(Tétrahydro-2-furanylméthyl)sulfanyl]benzoate de (7-méthoxy-2-oxo-2H-chromén-4-yl)méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 2-[[(tetrahydro-2-furanyl)methyl]thio]-, (7-methoxy-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: 1.3±0.1 g/cm3
Boiling Point: 634.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.8±3.0 kJ/mol
Flash Point: 330.7±19.5 °C
Index of Refraction: 1.634
Molar Refractivity: 113.2±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.52
ACD/LogD (pH 5.5): 4.72
ACD/BCF (pH 5.5): 2294.39
ACD/KOC (pH 5.5): 8854.44
ACD/LogD (pH 7.4): 4.72
ACD/BCF (pH 7.4): 2294.39
ACD/KOC (pH 7.4): 8854.44
Polar Surface Area: 96 Å2
Polarizability: 44.9±0.5 10-24cm3
Surface Tension: 59.7±5.0 dyne/cm
Molar Volume: 316.5±5.0 cm3

Click to predict properties on the Chemicalize site


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