ChemSpider 2D Image | Ethyl (8-hydroxy-4,9-dioxo-4,9-dihydronaphtho[2,3-b]thiophen-7-yl)acetate | C16H12O5S

Ethyl (8-hydroxy-4,9-dioxo-4,9-dihydronaphtho[2,3-b]thiophen-7-yl)acetate

  • Molecular FormulaC16H12O5S
  • Average mass316.328 Da
  • Monoisotopic mass316.040558 Da
  • ChemSpider ID58108816

More details:

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

(8-Hydroxy-4,9-dioxo-4,9-dihydronaphto[2,3-b]thiophén-7-yl)acétate d'éthyle [French] [ACD/IUPAC Name]
Ethyl (8-hydroxy-4,9-dioxo-4,9-dihydronaphtho[2,3-b]thiophen-7-yl)acetate [ACD/IUPAC Name]
Ethyl-(8-hydroxy-4,9-dioxo-4,9-dihydronaphtho[2,3-b]thiophen-7-yl)acetat [German] [ACD/IUPAC Name]
Naphtho[2,3-b]thiophene-7-acetic acid, 4,9-dihydro-8-hydroxy-4,9-dioxo-, ethyl ester [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 513.3±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.4±3.0 kJ/mol
Flash Point: 264.2±30.1 °C
Index of Refraction: 1.657
Molar Refractivity: 79.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.93
ACD/LogD (pH 5.5): 3.57
ACD/BCF (pH 5.5): 290.71
ACD/KOC (pH 5.5): 1919.79
ACD/LogD (pH 7.4): 2.44
ACD/BCF (pH 7.4): 21.52
ACD/KOC (pH 7.4): 142.12
Polar Surface Area: 109 Å2
Polarizability: 31.5±0.5 10-24cm3
Surface Tension: 67.1±3.0 dyne/cm
Molar Volume: 216.3±3.0 cm3

Click to predict properties on the Chemicalize site


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