ChemSpider 2D Image | Propyl 3-bromobenzoate | C10H11BrO2

Propyl 3-bromobenzoate

  • Molecular FormulaC10H11BrO2
  • Average mass243.097 Da
  • Monoisotopic mass241.994232 Da
  • ChemSpider ID37939679

More details:

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

3-Bromobenzoate de propyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-bromo-, propyl ester [ACD/Index Name]
Propyl 3-bromobenzoate [ACD/IUPAC Name]
Propyl-3-brombenzoat [German] [ACD/IUPAC Name]
1087738-72-4 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 278.6±13.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 51.7±3.0 kJ/mol
Flash Point: 122.3±19.8 °C
Index of Refraction: 1.535
Molar Refractivity: 55.0±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.94
ACD/LogD (pH 5.5): 3.62
ACD/BCF (pH 5.5): 330.90
ACD/KOC (pH 5.5): 2214.15
ACD/LogD (pH 7.4): 3.62
ACD/BCF (pH 7.4): 330.90
ACD/KOC (pH 7.4): 2214.15
Polar Surface Area: 26 Å2
Polarizability: 21.8±0.5 10-24cm3
Surface Tension: 39.4±3.0 dyne/cm
Molar Volume: 176.5±3.0 cm3

Click to predict properties on the Chemicalize site


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