ChemSpider 2D Image | 4-Chloro-5-isopropyl-2-methylphenyl (3,4,5-trimethoxyphenyl)acetate | C21H25ClO5

4-Chloro-5-isopropyl-2-methylphenyl (3,4,5-trimethoxyphenyl)acetate

  • Molecular FormulaC21H25ClO5
  • Average mass392.873 Da
  • Monoisotopic mass392.139038 Da
  • ChemSpider ID22459388

More details:

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

(3,4,5-Triméthoxyphényl)acétate de 4-chloro-5-isopropyl-2-méthylphényle [French] [ACD/IUPAC Name]
4-Chlor-5-isopropyl-2-methylphenyl-(3,4,5-trimethoxyphenyl)acetat [German] [ACD/IUPAC Name]
4-Chloro-5-isopropyl-2-methylphenyl (3,4,5-trimethoxyphenyl)acetate [ACD/IUPAC Name]
Benzeneacetic acid, 3,4,5-trimethoxy-, 4-chloro-2-methyl-5-(1-methylethyl)phenyl ester [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: 487.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.4±3.0 kJ/mol
Flash Point: 164.2±27.7 °C
Index of Refraction: 1.540
Molar Refractivity: 106.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 4.99
ACD/LogD (pH 5.5): 4.67
ACD/BCF (pH 5.5): 2080.13
ACD/KOC (pH 5.5): 8254.41
ACD/LogD (pH 7.4): 4.67
ACD/BCF (pH 7.4): 2080.13
ACD/KOC (pH 7.4): 8254.41
Polar Surface Area: 54 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 38.0±3.0 dyne/cm
Molar Volume: 338.1±3.0 cm3

Click to predict properties on the Chemicalize site


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