ChemSpider 2D Image | 2-(Methoxycarbonyl)cyclohexyl 4-ethoxy-3-methoxybenzoate | C18H24O6

2-(Methoxycarbonyl)cyclohexyl 4-ethoxy-3-methoxybenzoate

  • Molecular FormulaC18H24O6
  • Average mass336.380 Da
  • Monoisotopic mass336.157288 Da
  • ChemSpider ID30407026

More details:






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

2-(Methoxycarbonyl)cyclohexyl 4-ethoxy-3-methoxybenzoate [ACD/IUPAC Name]
2-(Methoxycarbonyl)cyclohexyl-4-ethoxy-3-methoxybenzoat [German] [ACD/IUPAC Name]
4-Éthoxy-3-méthoxybenzoate de 2-(méthoxycarbonyl)cyclohexyle [French] [ACD/IUPAC Name]
Benzoic acid, 4-ethoxy-3-methoxy-, 2-(methoxycarbonyl)cyclohexyl 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: 441.7±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.9±3.0 kJ/mol
Flash Point: 192.5±28.8 °C
Index of Refraction: 1.522
Molar Refractivity: 87.4±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.98
ACD/LogD (pH 5.5): 3.36
ACD/BCF (pH 5.5): 211.16
ACD/KOC (pH 5.5): 1605.34
ACD/LogD (pH 7.4): 3.36
ACD/BCF (pH 7.4): 211.16
ACD/KOC (pH 7.4): 1605.34
Polar Surface Area: 71 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 44.1±5.0 dyne/cm
Molar Volume: 286.7±5.0 cm3

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