ChemSpider 2D Image | 3-[4-(Carboxymethoxy)phenyl]propanoic acid | C11H12O5

3-[4-(Carboxymethoxy)phenyl]propanoic acid

  • Molecular FormulaC11H12O5
  • Average mass224.210 Da
  • Monoisotopic mass224.068466 Da
  • ChemSpider ID30653910

More details:

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

3-[4-(Carboxymethoxy)phenyl]propanoic acid [ACD/IUPAC Name]
3-[4-(Carboxymethoxy)phenyl]propansäure [German] [ACD/IUPAC Name]
Acide 3-[4-(carboxyméthoxy)phényl]propanoïque [French] [ACD/IUPAC Name]
Benzenepropanoic acid, 4-(carboxymethoxy)- [ACD/Index Name]
14234-87-8 [RN]
3-(4-(carboxymethoxy)phenyl) propanoic acid

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

Density: 1.3±0.1 g/cm3
Boiling Point: 434.9±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.8±3.0 kJ/mol
Flash Point: 172.5±16.7 °C
Index of Refraction: 1.565
Molar Refractivity: 54.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 0.96
ACD/LogD (pH 5.5): -2.04
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -3.63
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 84 Å2
Polarizability: 21.8±0.5 10-24cm3
Surface Tension: 57.3±3.0 dyne/cm
Molar Volume: 168.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement