ChemSpider 2D Image | Methyl 3-amino-6-fluoro-1H-indole-2-carboxylate | C10H9FN2O2

Methyl 3-amino-6-fluoro-1H-indole-2-carboxylate

  • Molecular FormulaC10H9FN2O2
  • Average mass208.189 Da
  • Monoisotopic mass208.064804 Da
  • ChemSpider ID21475755

More details:

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

1H-Indole-2-carboxylic acid, 3-amino-6-fluoro-, methyl ester [ACD/Index Name]
3-Amino-6-fluoro-1H-indole-2-carboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 3-amino-6-fluoro-1H-indole-2-carboxylate [ACD/IUPAC Name]
Methyl-3-amino-6-fluor-1H-indol-2-carboxylat [German] [ACD/IUPAC Name]
3-Amino-6-fluoro-1H-indole-2-carboxylic acid methyl ester
methyl 3-amino-6-fluoroindole-2-carboxylate
methyl3-amino-6-fluoro-1h-indole-2-carboxylate

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

MFCD08848266 [DBID]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 396.5±37.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.7±3.0 kJ/mol
Flash Point: 193.6±26.5 °C
Index of Refraction: 1.668
Molar Refractivity: 54.5±0.3 cm3
#H bond acceptors: 4
#H bond donors: 3
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.46
ACD/LogD (pH 5.5): 2.55
ACD/BCF (pH 5.5): 51.36
ACD/KOC (pH 5.5): 583.53
ACD/LogD (pH 7.4): 2.55
ACD/BCF (pH 7.4): 51.37
ACD/KOC (pH 7.4): 583.62
Polar Surface Area: 68 Å2
Polarizability: 21.6±0.5 10-24cm3
Surface Tension: 60.9±3.0 dyne/cm
Molar Volume: 146.3±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement