ChemSpider 2D Image | 2-{[3,5-Dichloro-2-(cyclobutyloxy)benzoyl]amino}-5-fluoro-2-indanecarboxylic acid | C21H18Cl2FNO4

2-{[3,5-Dichloro-2-(cyclobutyloxy)benzoyl]amino}-5-fluoro-2-indanecarboxylic acid

  • Molecular FormulaC21H18Cl2FNO4
  • Average mass438.276 Da
  • Monoisotopic mass437.059692 Da
  • ChemSpider ID58906532

More details:

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

1H-Indene-2-carboxylic acid, 2-[[3,5-dichloro-2-(cyclobutyloxy)benzoyl]amino]-5-fluoro-2,3-dihydro- [ACD/Index Name]
2-{[3,5-Dichlor-2-(cyclobutyloxy)benzoyl]amino}-5-fluor-2-indancarbonsäure [German] [ACD/IUPAC Name]
2-{[3,5-Dichloro-2-(cyclobutyloxy)benzoyl]amino}-5-fluoro-2-indanecarboxylic acid [ACD/IUPAC Name]
Acide 2-{[3,5-dichloro-2-(cyclobutyloxy)benzoyl]amino}-5-fluoro-2-indanecarboxylique [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 578.5±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 91.1±3.0 kJ/mol
Flash Point: 303.6±30.1 °C
Index of Refraction: 1.649
Molar Refractivity: 106.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.42
ACD/LogD (pH 5.5): 2.91
ACD/BCF (pH 5.5): 30.91
ACD/KOC (pH 5.5): 105.21
ACD/LogD (pH 7.4): 1.43
ACD/BCF (pH 7.4): 1.02
ACD/KOC (pH 7.4): 3.47
Polar Surface Area: 76 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 65.4±5.0 dyne/cm
Molar Volume: 290.9±5.0 cm3

Click to predict properties on the Chemicalize site


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