ChemSpider 2D Image | 3-Chloro-5-methoxy-4-[2-(3-methylbutoxy)ethoxy]benzoic acid | C15H21ClO5

3-Chloro-5-methoxy-4-[2-(3-methylbutoxy)ethoxy]benzoic acid

  • Molecular FormulaC15H21ClO5
  • Average mass316.777 Da
  • Monoisotopic mass316.107758 Da
  • ChemSpider ID38611230

More details:

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

3-Chlor-5-methoxy-4-[2-(3-methylbutoxy)ethoxy]benzoesäure [German] [ACD/IUPAC Name]
3-Chloro-5-methoxy-4-[2-(3-methylbutoxy)ethoxy]benzoic acid [ACD/IUPAC Name]
Acide 3-chloro-5-méthoxy-4-[2-(3-méthylbutoxy)éthoxy]benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-chloro-5-methoxy-4-[2-(3-methylbutoxy)ethoxy]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 426.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.8±3.0 kJ/mol
Flash Point: 211.5±28.7 °C
Index of Refraction: 1.517
Molar Refractivity: 80.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.79
ACD/LogD (pH 5.5): 2.37
ACD/BCF (pH 5.5): 15.71
ACD/KOC (pH 5.5): 89.65
ACD/LogD (pH 7.4): 0.96
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.47
Polar Surface Area: 65 Å2
Polarizability: 32.1±0.5 10-24cm3
Surface Tension: 40.3±3.0 dyne/cm
Molar Volume: 267.7±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement