Found 1345 results

Search term: MF = 'C_{15}H_{19}BrO_{3}'
ChemSpider 2D Image | Ethyl 7-(4-bromophenyl)-7-oxoheptanoate | C15H19BrO3

Ethyl 7-(4-bromophenyl)-7-oxoheptanoate

  • Molecular FormulaC15H19BrO3
  • Average mass327.214 Da
  • Monoisotopic mass326.051758 Da
  • ChemSpider ID21402046

More details:

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

122115-53-1 [RN]
7-(4-Bromophényl)-7-oxoheptanoate d'éthyle [French] [ACD/IUPAC Name]
Benzeneheptanoic acid, 4-bromo-ζ-oxo-, ethyl ester [ACD/Index Name]
Ethyl 7-(4-bromophenyl)-7-oxoheptanoate [ACD/IUPAC Name]
Ethyl-7-(4-bromphenyl)-7-oxoheptanoat [German] [ACD/IUPAC Name]
[122115-53-1] [RN]
97%
MFCD00672071 [MDL number]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 407.4±30.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 65.9±3.0 kJ/mol
Flash Point: 200.2±24.6 °C
Index of Refraction: 1.522
Molar Refractivity: 78.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.98
ACD/LogD (pH 5.5): 3.83
ACD/BCF (pH 5.5): 475.92
ACD/KOC (pH 5.5): 2872.00
ACD/LogD (pH 7.4): 3.83
ACD/BCF (pH 7.4): 475.92
ACD/KOC (pH 7.4): 2872.00
Polar Surface Area: 43 Å2
Polarizability: 31.0±0.5 10-24cm3
Surface Tension: 40.5±3.0 dyne/cm
Molar Volume: 256.2±3.0 cm3

Click to predict properties on the Chemicalize site


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