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Search term: 1020058-44-9 (Found by approved synonym)

ChemSpider 2D Image | MFCD09991882 | C11H10BrFO3

MFCD09991882

  • Molecular FormulaC11H10BrFO3
  • Average mass289.098 Da
  • Monoisotopic mass287.979736 Da
  • ChemSpider ID28595497

More details:






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

1020058-44-9 [RN]
3-(3-Bromo-5-fluorophényl)-3-oxopropanoate d'éthyle [French] [ACD/IUPAC Name]
Benzenepropanoic acid, 3-bromo-5-fluoro-β-oxo-, ethyl ester [ACD/Index Name]
ETHYL (3-BROMO-5-FLUOROBENZOYL)ACETATE
Ethyl 3-(3-bromo-5-fluorophenyl)-3-oxopropanoate [ACD/IUPAC Name]
Ethyl-3-(3-brom-5-fluorphenyl)-3-oxopropanoat [German] [ACD/IUPAC Name]
MFCD09991882
Ethyl(3-bromo-5-fluorobenzoyl)acetate

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

Density: 1.5±0.1 g/cm3
Boiling Point: 331.2±32.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.4±3.0 kJ/mol
Flash Point: 154.1±25.1 °C
Index of Refraction: 1.526
Molar Refractivity: 59.6±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.87
ACD/LogD (pH 5.5): 2.79
ACD/BCF (pH 5.5): 77.84
ACD/KOC (pH 5.5): 785.81
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 77.71
ACD/KOC (pH 7.4): 784.49
Polar Surface Area: 43 Å2
Polarizability: 23.6±0.5 10-24cm3
Surface Tension: 41.8±3.0 dyne/cm
Molar Volume: 194.4±3.0 cm3

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