ChemSpider 2D Image | (3S)-6-Fluoro-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylic acid | C13H12FNO2

(3S)-6-Fluoro-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylic acid

  • Molecular FormulaC13H12FNO2
  • Average mass233.238 Da
  • Monoisotopic mass233.085205 Da
  • ChemSpider ID32806260

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(3S)-6-Fluor-2,3,4,9-tetrahydro-1H-carbazol-3-carbonsäure [German] [ACD/IUPAC Name]
(3S)-6-Fluoro-2,3,4,9-tetrahydro-1H-carbazole-3-carboxylic acid [ACD/IUPAC Name]
1H-Carbazole-3-carboxylic acid, 6-fluoro-2,3,4,9-tetrahydro-, (3S)- [ACD/Index Name]
907211-32-9 [RN]
Acide (3S)-6-fluoro-2,3,4,9-tétrahydro-1H-carbazole-3-carboxylique [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 456.9±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.5±3.0 kJ/mol
Flash Point: 230.1±28.7 °C
Index of Refraction: 1.666
Molar Refractivity: 61.4±0.3 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 1
#Rule of 5 Violations: 0
ACD/LogP: 2.74
ACD/LogD (pH 5.5): 1.55
ACD/BCF (pH 5.5): 5.14
ACD/KOC (pH 5.5): 59.32
ACD/LogD (pH 7.4): -0.26
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 53 Å2
Polarizability: 24.3±0.5 10-24cm3
Surface Tension: 63.6±3.0 dyne/cm
Molar Volume: 165.2±3.0 cm3

Click to predict properties on the Chemicalize site


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