ChemSpider 2D Image | 5-(2-Chloro-4,5-dimethoxyphenyl)-5-hydroxy-3,3-dimethylpentanoic acid | C15H21ClO5

5-(2-Chloro-4,5-dimethoxyphenyl)-5-hydroxy-3,3-dimethylpentanoic acid

  • Molecular FormulaC15H21ClO5
  • Average mass316.777 Da
  • Monoisotopic mass316.107758 Da
  • ChemSpider ID40456467

More details:

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

5-(2-Chlor-4,5-dimethoxyphenyl)-5-hydroxy-3,3-dimethylpentansäure [German] [ACD/IUPAC Name]
5-(2-Chloro-4,5-dimethoxyphenyl)-5-hydroxy-3,3-dimethylpentanoic acid [ACD/IUPAC Name]
Acide 5-(2-chloro-4,5-diméthoxyphényl)-5-hydroxy-3,3-diméthylpentanoïque [French] [ACD/IUPAC Name]
Benzenepentanoic acid, 2-chloro-δ-hydroxy-4,5-dimethoxy-β,β-dimethyl- [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: 476.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 78.0±3.0 kJ/mol
Flash Point: 241.9±28.7 °C
Index of Refraction: 1.536
Molar Refractivity: 80.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.53
ACD/LogD (pH 5.5): 1.67
ACD/BCF (pH 5.5): 6.76
ACD/KOC (pH 5.5): 77.30
ACD/LogD (pH 7.4): -0.13
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.22
Polar Surface Area: 76 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 44.2±3.0 dyne/cm
Molar Volume: 257.7±3.0 cm3

Click to predict properties on the Chemicalize site


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