Found 78 results

Search term: MF = 'C_{29}H_{34}O_{9}'
ChemSpider 2D Image | 5-[2,4-Bis(2-ethoxy-2-oxoethyl)-6-oxocyclohexyl]-2,4-dimethoxyphenyl benzoate | C29H34O9

5-[2,4-Bis(2-ethoxy-2-oxoethyl)-6-oxocyclohexyl]-2,4-dimethoxyphenyl benzoate

  • Molecular FormulaC29H34O9
  • Average mass526.575 Da
  • Monoisotopic mass526.220276 Da
  • ChemSpider ID496870

More details:

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

1,3-Cyclohexanediacetic acid, 4-[5-(benzoyloxy)-2,4-dimethoxyphenyl]-5-oxo-, diethyl ester [ACD/Index Name]
5-[2,4-Bis(2-ethoxy-2-oxoethyl)-6-oxocyclohexyl]-2,4-dimethoxyphenyl benzoate [ACD/IUPAC Name]
5-[2,4-Bis(2-ethoxy-2-oxoethyl)-6-oxocyclohexyl]-2,4-dimethoxyphenyl-benzoat [German] [ACD/IUPAC Name]
Benzoate de 5-[2,4-bis(2-éthoxy-2-oxoéthyl)-6-oxocyclohexyl]-2,4-diméthoxyphényle [French] [ACD/IUPAC Name]
Benzoic acid, 5-[2,4-bis(ethoxycarbonylmethyl)-6-oxocyclohexyl]-2,4-dimethoxyphenyl ester

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

Density: 1.2±0.1 g/cm3
Boiling Point: 656.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.6±3.0 kJ/mol
Flash Point: 275.8±31.5 °C
Index of Refraction: 1.530
Molar Refractivity: 138.0±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 4.19
ACD/LogD (pH 5.5): 4.52
ACD/BCF (pH 5.5): 1602.75
ACD/KOC (pH 5.5): 6849.22
ACD/LogD (pH 7.4): 4.52
ACD/BCF (pH 7.4): 1602.75
ACD/KOC (pH 7.4): 6849.22
Polar Surface Area: 114 Å2
Polarizability: 54.7±0.5 10-24cm3
Surface Tension: 42.4±3.0 dyne/cm
Molar Volume: 446.7±3.0 cm3

Click to predict properties on the Chemicalize site


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