ChemSpider 2D Image | 4-(2,5-Dichloro-4-methoxyphenyl)-4-hydroxy-2,2-dimethylbutanoic acid | C13H16Cl2O4

4-(2,5-Dichloro-4-methoxyphenyl)-4-hydroxy-2,2-dimethylbutanoic acid

  • Molecular FormulaC13H16Cl2O4
  • Average mass307.170 Da
  • Monoisotopic mass306.042572 Da
  • ChemSpider ID71596930

More details:

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

4-(2,5-Dichlor-4-methoxyphenyl)-4-hydroxy-2,2-dimethylbutansäure [German] [ACD/IUPAC Name]
4-(2,5-Dichloro-4-methoxyphenyl)-4-hydroxy-2,2-dimethylbutanoic acid [ACD/IUPAC Name]
Acide 4-(2,5-dichloro-4-méthoxyphényl)-4-hydroxy-2,2-diméthylbutanoïque [French] [ACD/IUPAC Name]
Benzenebutanoic acid, 2,5-dichloro-γ-hydroxy-4-methoxy-α,α-dimethyl- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 452.0±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 74.9±3.0 kJ/mol
Flash Point: 227.1±28.7 °C
Index of Refraction: 1.558
Molar Refractivity: 73.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.04
ACD/LogD (pH 5.5): 2.14
ACD/BCF (pH 5.5): 15.06
ACD/KOC (pH 5.5): 132.91
ACD/LogD (pH 7.4): 0.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.09
Polar Surface Area: 67 Å2
Polarizability: 29.3±0.5 10-24cm3
Surface Tension: 48.2±3.0 dyne/cm
Molar Volume: 229.1±3.0 cm3

Click to predict properties on the Chemicalize site


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