ChemSpider 2D Image | 5-Fluoro-4-(methoxycarbonyl)-1-methyl-1H-indazole-3-carboxylic acid | C11H9FN2O4

5-Fluoro-4-(methoxycarbonyl)-1-methyl-1H-indazole-3-carboxylic acid

  • Molecular FormulaC11H9FN2O4
  • Average mass252.199 Da
  • Monoisotopic mass252.054642 Da
  • ChemSpider ID65654108

More details:

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

1H-Indazole-3,4-dicarboxylic acid, 5-fluoro-1-methyl-, 4-methyl ester [ACD/Index Name]
5-Fluor-4-(methoxycarbonyl)-1-methyl-1H-indazol-3-carbonsäure [German] [ACD/IUPAC Name]
5-Fluoro-4-(methoxycarbonyl)-1-methyl-1H-indazole-3-carboxylic acid [ACD/IUPAC Name]
Acide 5-fluoro-4-(méthoxycarbonyl)-1-méthyl-1H-indazole-3-carboxylique [French] [ACD/IUPAC Name]
2060050-37-3 [RN]
MFCD30499220

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

Density: 1.5±0.1 g/cm3
Boiling Point: 458.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.8±3.0 kJ/mol
Flash Point: 231.3±28.7 °C
Index of Refraction: 1.616
Molar Refractivity: 58.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 1.14
ACD/LogD (pH 5.5): -1.36
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.52
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 81 Å2
Polarizability: 23.2±0.5 10-24cm3
Surface Tension: 49.4±7.0 dyne/cm
Molar Volume: 167.7±7.0 cm3

Click to predict properties on the Chemicalize site


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