ChemSpider 2D Image | N-[1-Benzothiophen-7-yl(3-fluoro-5-methylphenyl)methyl]ethanamine | C18H18FNS

N-[1-Benzothiophen-7-yl(3-fluoro-5-methylphenyl)methyl]ethanamine

  • Molecular FormulaC18H18FNS
  • Average mass299.406 Da
  • Monoisotopic mass299.114410 Da
  • ChemSpider ID37152404

More details:

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

Benzo[b]thiophene-7-methanamine, N-ethyl-α-(3-fluoro-5-methylphenyl)- [ACD/Index Name]
N-[1-Benzothiophen-7-yl(3-fluor-5-methylphenyl)methyl]ethanamin [German] [ACD/IUPAC Name]
N-[1-Benzothiophen-7-yl(3-fluoro-5-methylphenyl)methyl]ethanamine [ACD/IUPAC Name]
N-[1-Benzothiophén-7-yl(3-fluoro-5-méthylphényl)méthyl]éthanamine [French] [ACD/IUPAC 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: 410.5±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.0 mmHg at 25°C
Enthalpy of Vaporization: 66.3±3.0 kJ/mol
Flash Point: 202.1±27.3 °C
Index of Refraction: 1.618
Molar Refractivity: 89.5±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: 6.63
ACD/LogD (pH 5.5): 2.56
ACD/BCF (pH 5.5): 12.29
ACD/KOC (pH 5.5): 37.83
ACD/LogD (pH 7.4): 4.24
ACD/BCF (pH 7.4): 585.42
ACD/KOC (pH 7.4): 1802.17
Polar Surface Area: 40 Å2
Polarizability: 35.5±0.5 10-24cm3
Surface Tension: 43.5±3.0 dyne/cm
Molar Volume: 255.5±3.0 cm3

Click to predict properties on the Chemicalize site


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