ChemSpider 2D Image | 3-{[5-Methoxy-4-(2-methoxyethoxy)-2-nitrobenzoyl]amino}hexanoic acid | C17H24N2O8

3-{[5-Methoxy-4-(2-methoxyethoxy)-2-nitrobenzoyl]amino}hexanoic acid

  • Molecular FormulaC17H24N2O8
  • Average mass384.381 Da
  • Monoisotopic mass384.153259 Da
  • ChemSpider ID30416136

More details:

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

3-{[5-Methoxy-4-(2-methoxyethoxy)-2-nitrobenzoyl]amino}hexanoic acid [ACD/IUPAC Name]
3-{[5-Methoxy-4-(2-methoxyethoxy)-2-nitrobenzoyl]amino}hexansäure [German] [ACD/IUPAC Name]
Acide 3-{[5-méthoxy-4-(2-méthoxyéthoxy)-2-nitrobenzoyl]amino}hexanoïque [French] [ACD/IUPAC Name]
Hexanoic acid, 3-[[5-methoxy-4-(2-methoxyethoxy)-2-nitrobenzoyl]amino]- [ACD/Index Name]
3-{[5-METHOXY-4-(2-METHOXYETHOXY)-2-NITROPHENYL]FORMAMIDO}HEXANOIC ACID

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

Density: 1.3±0.1 g/cm3
Boiling Point: 565.9±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.4±3.0 kJ/mol
Flash Point: 296.1±30.1 °C
Index of Refraction: 1.535
Molar Refractivity: 95.5±0.3 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 2.20
ACD/LogD (pH 5.5): 0.36
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.00
ACD/LogD (pH 7.4): -1.42
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 140 Å2
Polarizability: 37.8±0.5 10-24cm3
Surface Tension: 47.9±3.0 dyne/cm
Molar Volume: 306.5±3.0 cm3

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