ChemSpider 2D Image | 4-Chloro-3-methylphenyl hexyl sebacate | C23H35ClO4

4-Chloro-3-methylphenyl hexyl sebacate

  • Molecular FormulaC23H35ClO4
  • Average mass410.975 Da
  • Monoisotopic mass410.222382 Da
  • ChemSpider ID29744232

More details:

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

4-Chlor-3-methylphenyl-hexylsebacat [German] [ACD/IUPAC Name]
4-Chloro-3-methylphenyl hexyl sebacate [ACD/IUPAC Name]
Decanedioic acid, 4-chloro-3-methylphenyl hexyl ester [ACD/Index Name]
Sébacate de 4-chloro-3-méthylphényle et d'hexyle [French] [ACD/IUPAC Name]
Sebacic acid, 4-chloro-3-methylphenyl hexyl ester

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

Density: 1.1±0.1 g/cm3
Boiling Point: 493.3±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.0±3.0 kJ/mol
Flash Point: 149.4±26.3 °C
Index of Refraction: 1.496
Molar Refractivity: 113.9±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 1
ACD/LogP: 7.74
ACD/LogD (pH 5.5): 7.65
ACD/BCF (pH 5.5): 385858.59
ACD/KOC (pH 5.5): 347006.84
ACD/LogD (pH 7.4): 7.65
ACD/BCF (pH 7.4): 385858.59
ACD/KOC (pH 7.4): 347006.84
Polar Surface Area: 53 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 37.4±3.0 dyne/cm
Molar Volume: 389.9±3.0 cm3

Click to predict properties on the Chemicalize site


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