ChemSpider 2D Image | 2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-5-methyl-3-nitrobenzoic acid | C23H18N2O6

2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-5-methyl-3-nitrobenzoic acid

  • Molecular FormulaC23H18N2O6
  • Average mass418.399 Da
  • Monoisotopic mass418.116486 Da
  • ChemSpider ID71103092

More details:

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

2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-5-methyl-3-nitrobenzoesäure [German] [ACD/IUPAC Name]
2-{[(9H-Fluoren-9-ylmethoxy)carbonyl]amino}-5-methyl-3-nitrobenzoic acid [ACD/IUPAC Name]
Acide 2-{[(9H-fluorén-9-ylméthoxy)carbonyl]amino}-5-méthyl-3-nitrobenzoïque [French] [ACD/IUPAC Name]
Benzoic acid, 2-[[(9H-fluoren-9-ylmethoxy)carbonyl]amino]-5-methyl-3-nitro- [ACD/Index Name]
2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-5-methyl-3-nitrobenzoic acid
2287309-78-6 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 593.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.1±3.0 kJ/mol
Flash Point: 312.9±30.1 °C
Index of Refraction: 1.690
Molar Refractivity: 112.4±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 7.20
ACD/LogD (pH 5.5): 3.48
ACD/BCF (pH 5.5): 55.05
ACD/KOC (pH 5.5): 96.95
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 26.04
ACD/KOC (pH 7.4): 45.86
Polar Surface Area: 121 Å2
Polarizability: 44.5±0.5 10-24cm3
Surface Tension: 68.4±3.0 dyne/cm
Molar Volume: 293.9±3.0 cm3

Click to predict properties on the Chemicalize site


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