ChemSpider 2D Image | 2-Methyl-2-propanyl 4-bromo-3-chlorobenzoate | C11H12BrClO2

2-Methyl-2-propanyl 4-bromo-3-chlorobenzoate

  • Molecular FormulaC11H12BrClO2
  • Average mass291.569 Da
  • Monoisotopic mass289.970917 Da
  • ChemSpider ID37477120

More details:

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

2-Methyl-2-propanyl 4-bromo-3-chlorobenzoate [ACD/IUPAC Name]
2-Methyl-2-propanyl-4-brom-3-chlorbenzoat [German] [ACD/IUPAC Name]
4-Bromo-3-chlorobenzoate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-bromo-3-chloro-, 1,1-dimethylethyl ester [ACD/Index Name]
1494593-59-7 [RN]
MFCD23085724
t-Butyl 4-bromo-3-chlorobenzoate
tert-butyl 4-bromo-3-chlorobenzoate

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

Density: 1.4±0.1 g/cm3
Boiling Point: 337.4±22.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.1±3.0 kJ/mol
Flash Point: 157.8±22.3 °C
Index of Refraction: 1.541
Molar Refractivity: 64.5±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.74
ACD/LogD (pH 5.5): 4.44
ACD/BCF (pH 5.5): 1402.01
ACD/KOC (pH 5.5): 6223.63
ACD/LogD (pH 7.4): 4.44
ACD/BCF (pH 7.4): 1402.01
ACD/KOC (pH 7.4): 6223.63
Polar Surface Area: 26 Å2
Polarizability: 25.6±0.5 10-24cm3
Surface Tension: 39.2±3.0 dyne/cm
Molar Volume: 205.0±3.0 cm3

Click to predict properties on the Chemicalize site


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