ChemSpider 2D Image | sec-Butyl 2-[(6-oxo-6H-benzo[c]chromen-3-yl)oxy]propanoate | C20H20O5

sec-Butyl 2-[(6-oxo-6H-benzo[c]chromen-3-yl)oxy]propanoate

  • Molecular FormulaC20H20O5
  • Average mass340.370 Da
  • Monoisotopic mass340.131073 Da
  • ChemSpider ID21918989

More details:

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

2-[(6-Oxo-6H-benzo[c]chromén-3-yl)oxy]propanoate de sec-butyle [French] [ACD/IUPAC Name]
Propanoic acid, 2-[(6-oxo-6H-dibenzo[b,d]pyran-3-yl)oxy]-, 1-methylpropyl ester [ACD/Index Name]
sec-Butyl 2-[(6-oxo-6H-benzo[c]chromen-3-yl)oxy]propanoate [ACD/IUPAC Name]
sec-Butyl-2-[(6-oxo-6H-benzo[c]chromen-3-yl)oxy]propanoat [German] [ACD/IUPAC Name]
BUTAN-2-YL 2-({6-OXO-6H-BENZO[C]CHROMEN-3-YL}OXY)PROPANOATE
sec-butyl 2-((6-oxo-6H-benzo[c]chromen-3-yl)oxy)propanoate
SEC-BUTYL 2-({6-OXOBENZO[C]CHROMEN-3-YL}OXY)PROPANOATE

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

Density: 1.2±0.1 g/cm3
Boiling Point: 482.3±28.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.7±3.0 kJ/mol
Flash Point: 211.8±24.0 °C
Index of Refraction: 1.567
Molar Refractivity: 91.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.11
ACD/LogD (pH 5.5): 4.99
ACD/BCF (pH 5.5): 3685.02
ACD/KOC (pH 5.5): 12429.44
ACD/LogD (pH 7.4): 4.99
ACD/BCF (pH 7.4): 3685.02
ACD/KOC (pH 7.4): 12429.44
Polar Surface Area: 62 Å2
Polarizability: 36.4±0.5 10-24cm3
Surface Tension: 45.7±3.0 dyne/cm
Molar Volume: 280.9±3.0 cm3

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