ChemSpider 2D Image | Ethyl 2-bromobenzoate | C9H9BrO2

Ethyl 2-bromobenzoate

  • Molecular FormulaC9H9BrO2
  • Average mass229.071 Da
  • Monoisotopic mass227.978592 Da
  • ChemSpider ID21170954

More details:

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

228-034-3 [EINECS]
2-Bromobenzoate d'éthyle [French] [ACD/IUPAC Name]
6091-64-1 [RN]
Benzoic acid, 2-bromo-, ethyl ester [ACD/Index Name]
Ethyl 2-bromobenzoate [ACD/IUPAC Name]
Ethyl-2-brombenzoat [German] [ACD/IUPAC Name]
[6091-64-1] [RN]
115010-11-2 [RN]
2-Bromobenzoic acid ethyl ester
2-Bromobezoic acid, ethyl ester
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

MFCD00015443 [DBID]
335800_ALDRICH [DBID]
CCRIS 4693 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 254.5±0.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.5 mmHg at 25°C
Enthalpy of Vaporization: 49.2±3.0 kJ/mol
Flash Point: 110.1±19.8 °C
Index of Refraction: 1.542
Molar Refractivity: 50.3±0.3 cm3
#H bond acceptors: 2
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.08
ACD/LogD (pH 5.5): 3.29
ACD/BCF (pH 5.5): 184.73
ACD/KOC (pH 5.5): 1458.79
ACD/LogD (pH 7.4): 3.29
ACD/BCF (pH 7.4): 184.73
ACD/KOC (pH 7.4): 1458.79
Polar Surface Area: 26 Å2
Polarizability: 20.0±0.5 10-24cm3
Surface Tension: 40.0±3.0 dyne/cm
Molar Volume: 160.0±3.0 cm3

Click to predict properties on the Chemicalize site


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