ChemSpider 2D Image | Propyl 4-(2-chloro-3,4-dimethoxyphenyl)-4-hydroxybutanoate | C15H21ClO5

Propyl 4-(2-chloro-3,4-dimethoxyphenyl)-4-hydroxybutanoate

  • Molecular FormulaC15H21ClO5
  • Average mass316.777 Da
  • Monoisotopic mass316.107758 Da
  • ChemSpider ID43260014

More details:

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

4-(2-Chloro-3,4-diméthoxyphényl)-4-hydroxybutanoate de propyle [French] [ACD/IUPAC Name]
Benzenebutanoic acid, 2-chloro-γ-hydroxy-3,4-dimethoxy-, propyl ester [ACD/Index Name]
Propyl 4-(2-chloro-3,4-dimethoxyphenyl)-4-hydroxybutanoate [ACD/IUPAC Name]
Propyl-4-(2-chlor-3,4-dimethoxyphenyl)-4-hydroxybutanoat [German] [ACD/IUPAC 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: 441.5±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 73.7±3.0 kJ/mol
Flash Point: 220.8±28.7 °C
Index of Refraction: 1.516
Molar Refractivity: 80.5±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.18
ACD/LogD (pH 5.5): 2.69
ACD/BCF (pH 5.5): 65.58
ACD/KOC (pH 5.5): 695.11
ACD/LogD (pH 7.4): 2.69
ACD/BCF (pH 7.4): 65.58
ACD/KOC (pH 7.4): 695.11
Polar Surface Area: 65 Å2
Polarizability: 31.9±0.5 10-24cm3
Surface Tension: 40.5±3.0 dyne/cm
Molar Volume: 266.5±3.0 cm3

Click to predict properties on the Chemicalize site


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