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Search term: COc1cc(ccc1Oc1ccccc1)C(O)=O (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | 3-Methoxy-4-phenoxybenzoic acid | C14H12O4

3-Methoxy-4-phenoxybenzoic acid

  • Molecular FormulaC14H12O4
  • Average mass244.243 Da
  • Monoisotopic mass244.073563 Da
  • ChemSpider ID23301123

More details:

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

3-Methoxy-4-phenoxybenzoesäure [German] [ACD/IUPAC Name]
3-Methoxy-4-phenoxybenzoic acid [ACD/IUPAC Name]
Acide 3-méthoxy-4-phénoxybenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-methoxy-4-phenoxy- [ACD/Index Name]
CHEMBL392872
HKA
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL392872/

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

Density: 1.2±0.1 g/cm3
Boiling Point: 393.5±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 67.9±3.0 kJ/mol
Flash Point: 149.5±17.2 °C
Index of Refraction: 1.590
Molar Refractivity: 66.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.13
ACD/LogD (pH 5.5): 1.74
ACD/BCF (pH 5.5): 5.90
ACD/KOC (pH 5.5): 51.25
ACD/LogD (pH 7.4): 0.20
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.48
Polar Surface Area: 56 Å2
Polarizability: 26.3±0.5 10-24cm3
Surface Tension: 47.9±3.0 dyne/cm
Molar Volume: 196.6±3.0 cm3

Click to predict properties on the Chemicalize site


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