ChemSpider 2D Image | 4-Ethoxy-3,5-diiodobenzoic acid | C9H8I2O3

4-Ethoxy-3,5-diiodobenzoic acid

  • Molecular FormulaC9H8I2O3
  • Average mass417.967 Da
  • Monoisotopic mass417.856262 Da
  • ChemSpider ID35517415

More details:

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

4-Ethoxy-3,5-diiodbenzoesäure [German] [ACD/IUPAC Name]
4-Ethoxy-3,5-diiodobenzoic acid [ACD/IUPAC Name]
Acide 4-éthoxy-3,5-diiodobenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 4-ethoxy-3,5-diiodo- [ACD/Index Name]
40689-27-8 [RN]
4-Ethoxy-3,5-diiodo-benzoic acid
MFCD29478376
VS-13256

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

Density: 2.2±0.1 g/cm3
Boiling Point: 448.8±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 74.5±3.0 kJ/mol
Flash Point: 225.2±28.7 °C
Index of Refraction: 1.677
Molar Refractivity: 70.3±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 4.68
ACD/LogD (pH 5.5): 2.60
ACD/BCF (pH 5.5): 21.72
ACD/KOC (pH 5.5): 103.54
ACD/LogD (pH 7.4): 1.28
ACD/BCF (pH 7.4): 1.04
ACD/KOC (pH 7.4): 4.96
Polar Surface Area: 47 Å2
Polarizability: 27.9±0.5 10-24cm3
Surface Tension: 58.9±3.0 dyne/cm
Molar Volume: 186.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement