Found 2 results

Search term: HRRHRVZKRPMRAV (Found by InChIKey (skeleton match))
ChemSpider 2D Image | (2S)-1-(5-Fluoro-1-methyl-1H-indol-3-yl)-2-propanamine | C12H15FN2

(2S)-1-(5-Fluoro-1-methyl-1H-indol-3-yl)-2-propanamine

  • Molecular FormulaC12H15FN2
  • Average mass206.259 Da
  • Monoisotopic mass206.121933 Da
  • ChemSpider ID97476591

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2S)-1-(5-Fluor-1-methyl-1H-indol-3-yl)-2-propanamin [German] [ACD/IUPAC Name]
(2S)-1-(5-Fluoro-1-methyl-1H-indol-3-yl)-2-propanamine [ACD/IUPAC Name]
(2S)-1-(5-Fluoro-1-méthyl-1H-indol-3-yl)-2-propanamine [French] [ACD/IUPAC Name]
1H-Indole-3-ethanamine, 5-fluoro-α,1-dimethyl-, (αS)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 339.6±27.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 58.3±3.0 kJ/mol
Flash Point: 159.2±23.7 °C
Index of Refraction: 1.569
Molar Refractivity: 58.1±0.5 cm3
#H bond acceptors: 2
#H bond donors: 2
#Freely Rotating Bonds: 2
#Rule of 5 Violations: 0
ACD/LogP: 2.27
ACD/LogD (pH 5.5): -0.89
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.53
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 31 Å2
Polarizability: 23.0±0.5 10-24cm3
Surface Tension: 35.9±7.0 dyne/cm
Molar Volume: 177.5±7.0 cm3

Click to predict properties on the Chemicalize site


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