ChemSpider 2D Image | 3-(3,5-Dimethyl-1,2-oxazol-4-yl)-5-ethoxybenzoic acid | C14H15NO4

3-(3,5-Dimethyl-1,2-oxazol-4-yl)-5-ethoxybenzoic acid

  • Molecular FormulaC14H15NO4
  • Average mass261.273 Da
  • Monoisotopic mass261.100098 Da
  • ChemSpider ID26327097

More details:






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

3-(3,5-Dimethyl-1,2-oxazol-4-yl)-5-ethoxybenzoesäure [German] [ACD/IUPAC Name]
3-(3,5-Dimethyl-1,2-oxazol-4-yl)-5-ethoxybenzoic acid [ACD/IUPAC Name]
Acide 3-(3,5-diméthyl-1,2-oxazol-4-yl)-5-éthoxybenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-(3,5-dimethyl-4-isoxazolyl)-5-ethoxy- [ACD/Index Name]
KRG

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 428.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.0±3.0 kJ/mol
Flash Point: 212.8±28.7 °C
Index of Refraction: 1.552
Molar Refractivity: 69.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.13
ACD/LogD (pH 5.5): 1.55
ACD/BCF (pH 5.5): 3.63
ACD/KOC (pH 5.5): 30.55
ACD/LogD (pH 7.4): 0.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.26
Polar Surface Area: 73 Å2
Polarizability: 27.4±0.5 10-24cm3
Surface Tension: 45.8±3.0 dyne/cm
Molar Volume: 216.3±3.0 cm3

Click to predict properties on the Chemicalize site






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