ChemSpider 2D Image | 5-(Octylcarbamoyl)-2-(octyloxy)benzoic acid | C24H39NO4

5-(Octylcarbamoyl)-2-(octyloxy)benzoic acid

  • Molecular FormulaC24H39NO4
  • Average mass405.571 Da
  • Monoisotopic mass405.287903 Da
  • ChemSpider ID28700354

More details:

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

5-(Octylcarbamoyl)-2-(octyloxy)benzoesäure [German] [ACD/IUPAC Name]
5-(Octylcarbamoyl)-2-(octyloxy)benzoic acid [ACD/IUPAC Name]
Acide 5-(octylcarbamoyl)-2-(octyloxy)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 5-[(octylamino)carbonyl]-2-(octyloxy)- [ACD/Index Name]
89366-45-0 [RN]

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

Density: 1.0±0.1 g/cm3
Boiling Point: 549.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.2±3.0 kJ/mol
Flash Point: 285.9±27.3 °C
Index of Refraction: 1.507
Molar Refractivity: 118.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 17
#Rule of 5 Violations: 1
ACD/LogP: 8.10
ACD/LogD (pH 5.5): 5.46
ACD/BCF (pH 5.5): 2390.19
ACD/KOC (pH 5.5): 2080.30
ACD/LogD (pH 7.4): 4.61
ACD/BCF (pH 7.4): 332.86
ACD/KOC (pH 7.4): 289.71
Polar Surface Area: 76 Å2
Polarizability: 46.9±0.5 10-24cm3
Surface Tension: 39.5±3.0 dyne/cm
Molar Volume: 397.4±3.0 cm3

Click to predict properties on the Chemicalize site


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