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Search term: FYVNDEUAQOZKPS (Found by InChIKey (skeleton match))
ChemSpider 2D Image | Methyl 2-{2-[4-(octadecyloxy)phenyl]ethyl}-1H-benzimidazole-4-carboxylate | C35H52N2O3

Methyl 2-{2-[4-(octadecyloxy)phenyl]ethyl}-1H-benzimidazole-4-carboxylate

  • Molecular FormulaC35H52N2O3
  • Average mass548.799 Da
  • Monoisotopic mass548.397766 Da
  • ChemSpider ID8341588

More details:

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

1H-Benzimidazole-4-carboxylic acid, 2-[2-[4-(octadecyloxy)phenyl]ethyl]-, methyl ester [ACD/Index Name]
2-{2-[4-(Octadécyloxy)phényl]éthyl}-1H-benzimidazole-4-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 2-{2-[4-(octadecyloxy)phenyl]ethyl}-1H-benzimidazole-4-carboxylate [ACD/IUPAC Name]
Methyl-2-{2-[4-(octadecyloxy)phenyl]ethyl}-1H-benzimidazol-4-carboxylat [German] [ACD/IUPAC 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: 690.8±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.2±3.0 kJ/mol
Flash Point: 371.6±27.3 °C
Index of Refraction: 1.545
Molar Refractivity: 167.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 23
#Rule of 5 Violations: 2
ACD/LogP: 12.67
ACD/LogD (pH 5.5): 11.50
ACD/BCF (pH 5.5): 1000000.00
ACD/KOC (pH 5.5): 10000000.00
ACD/LogD (pH 7.4): 11.59
ACD/BCF (pH 7.4): 1000000.00
ACD/KOC (pH 7.4): 10000000.00
Polar Surface Area: 64 Å2
Polarizability: 66.5±0.5 10-24cm3
Surface Tension: 41.9±3.0 dyne/cm
Molar Volume: 531.1±3.0 cm3

Click to predict properties on the Chemicalize site


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