Found 134 results

Search term: MF = 'C_{25}H_{39}NO_{6}'
ChemSpider 2D Image | 3-Nitro-4-(stearoyloxy)benzoic acid | C25H39NO6

3-Nitro-4-(stearoyloxy)benzoic acid

  • Molecular FormulaC25H39NO6
  • Average mass449.580 Da
  • Monoisotopic mass449.277740 Da
  • ChemSpider ID57510454

More details:

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

3-Nitro-4-(stearoyloxy)benzoesäure [German] [ACD/IUPAC Name]
3-Nitro-4-(stearoyloxy)benzoic acid [ACD/IUPAC Name]
Acide 3-nitro-4-(stearoyloxy)benzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 3-nitro-4-[(1-oxooctadecyl)oxy]- [ACD/Index Name]
3-NITRO-4-(OCTADECANOYLOXY)BENZOIC ACID
43049-40-7 [RN]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 568.2±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.7±3.0 kJ/mol
Flash Point: 297.4±28.7 °C
Index of Refraction: 1.514
Molar Refractivity: 125.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 20
#Rule of 5 Violations: 1
ACD/LogP: 10.17
ACD/LogD (pH 5.5): 7.60
ACD/BCF (pH 5.5): 113770.41
ACD/KOC (pH 5.5): 37731.08
ACD/LogD (pH 7.4): 6.57
ACD/BCF (pH 7.4): 10464.61
ACD/KOC (pH 7.4): 3470.50
Polar Surface Area: 109 Å2
Polarizability: 49.6±0.5 10-24cm3
Surface Tension: 42.8±3.0 dyne/cm
Molar Volume: 415.5±3.0 cm3

Click to predict properties on the Chemicalize site


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