ChemSpider 2D Image | 4-{[5-Methoxy-4-(2-methoxyethoxy)-2-nitrobenzoyl]amino}cyclohexanecarboxylic acid | C18H24N2O8

4-{[5-Methoxy-4-(2-methoxyethoxy)-2-nitrobenzoyl]amino}cyclohexanecarboxylic acid

  • Molecular FormulaC18H24N2O8
  • Average mass396.392 Da
  • Monoisotopic mass396.153259 Da
  • ChemSpider ID53700840

More details:

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

4-{[5-Methoxy-4-(2-methoxyethoxy)-2-nitrobenzoyl]amino}cyclohexancarbonsäure [German] [ACD/IUPAC Name]
4-{[5-Methoxy-4-(2-methoxyethoxy)-2-nitrobenzoyl]amino}cyclohexanecarboxylic acid [ACD/IUPAC Name]
Acide 4-{[5-méthoxy-4-(2-méthoxyéthoxy)-2-nitrobenzoyl]amino}cyclohexanecarboxylique [French] [ACD/IUPAC Name]
Cyclohexanecarboxylic acid, 4-[[5-methoxy-4-(2-methoxyethoxy)-2-nitrobenzoyl]amino]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 592.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.9±3.0 kJ/mol
Flash Point: 312.0±30.1 °C
Index of Refraction: 1.567
Molar Refractivity: 96.9±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 1.77
ACD/LogD (pH 5.5): 0.64
ACD/BCF (pH 5.5): 1.12
ACD/KOC (pH 5.5): 21.35
ACD/LogD (pH 7.4): -1.16
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 140 Å2
Polarizability: 38.4±0.5 10-24cm3
Surface Tension: 58.7±5.0 dyne/cm
Molar Volume: 296.6±5.0 cm3

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