Found 25 results

Search term: MF = 'C_{40}H_{54}O_{5}'
ChemSpider 2D Image | 4-{[(2-Methyloctyl)oxy]carbonyl}phenyl 4'-(11-hydroxyundecyl)-4-biphenylcarboxylate | C40H54O5

4-{[(2-Methyloctyl)oxy]carbonyl}phenyl 4'-(11-hydroxyundecyl)-4-biphenylcarboxylate

  • Molecular FormulaC40H54O5
  • Average mass614.854 Da
  • Monoisotopic mass614.397095 Da
  • ChemSpider ID9824968

More details:

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

4'-(11-Hydroxyundécyl)-4-biphénylcarboxylate de 4-{[(2-méthyloctyl)oxy]carbonyl}phényle [French] [ACD/IUPAC Name]
4-{[(2-Methyloctyl)oxy]carbonyl}phenyl 4'-(11-hydroxyundecyl)-4-biphenylcarboxylate [ACD/IUPAC Name]
4-{[(2-Methyloctyl)oxy]carbonyl}phenyl-4'-(11-hydroxyundecyl)-4-biphenylcarboxylat [German] [ACD/IUPAC Name]
Benzoic acid, 4-[[[4'-(11-hydroxyundecyl)[1,1'-biphenyl]-4-yl]carbonyl]oxy]-, 2-methyloctyl ester [ACD/Index Name]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 716.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.9±3.0 kJ/mol
Flash Point: 211.0±25.0 °C
Index of Refraction: 1.539
Molar Refractivity: 184.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 24
#Rule of 5 Violations: 2
ACD/LogP: 13.30
ACD/LogD (pH 5.5): 11.91
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.91
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 73 Å2
Polarizability: 73.0±0.5 10-24cm3
Surface Tension: 41.4±3.0 dyne/cm
Molar Volume: 587.3±3.0 cm3

Click to predict properties on the Chemicalize site


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