ChemSpider 2D Image | Methyl 4-chloro-2-fluoro-5-hydroxybenzoate | C8H6ClFO3

Methyl 4-chloro-2-fluoro-5-hydroxybenzoate

  • Molecular FormulaC8H6ClFO3
  • Average mass204.583 Da
  • Monoisotopic mass203.998947 Da
  • ChemSpider ID60847829

More details:

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

141852-67-7 [RN]
4-Chloro-2-fluoro-5-hydroxybenzoate de méthyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-chloro-2-fluoro-5-hydroxy-, methyl ester [ACD/Index Name]
Methyl 4-chloro-2-fluoro-5-hydroxybenzoate [ACD/IUPAC Name]
Methyl-4-chlor-2-fluor-5-hydroxybenzoat [German] [ACD/IUPAC Name]
MFCD23111317

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

Density: 1.4±0.1 g/cm3
Boiling Point: 309.1±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.2±3.0 kJ/mol
Flash Point: 140.8±27.9 °C
Index of Refraction: 1.544
Molar Refractivity: 44.8±0.3 cm3
#H bond acceptors: 3
#H bond donors: 1
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 1.96
ACD/LogD (pH 5.5): 2.54
ACD/BCF (pH 5.5): 50.36
ACD/KOC (pH 5.5): 574.36
ACD/LogD (pH 7.4): 2.37
ACD/BCF (pH 7.4): 33.89
ACD/KOC (pH 7.4): 386.53
Polar Surface Area: 47 Å2
Polarizability: 17.8±0.5 10-24cm3
Surface Tension: 46.3±3.0 dyne/cm
Molar Volume: 141.9±3.0 cm3

Click to predict properties on the Chemicalize site


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