ChemSpider 2D Image | 2-{4-[(2-Fluoroethyl)sulfanyl]-2,5-dimethoxyphenyl}ethanamine | C12H18FNO2S

2-{4-[(2-Fluoroethyl)sulfanyl]-2,5-dimethoxyphenyl}ethanamine

  • Molecular FormulaC12H18FNO2S
  • Average mass259.340 Da
  • Monoisotopic mass259.104218 Da
  • ChemSpider ID21106231

More details:






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

2-{4-[(2-Fluorethyl)sulfanyl]-2,5-dimethoxyphenyl}ethanamin [German] [ACD/IUPAC Name]
2-{4-[(2-Fluoroethyl)sulfanyl]-2,5-dimethoxyphenyl}ethanamine [ACD/IUPAC Name]
2-{4-[(2-Fluoroéthyl)sulfanyl]-2,5-diméthoxyphényl}éthanamine [French] [ACD/IUPAC Name]
207740-33-8 [RN]
2C-T-21
Benzeneethanamine, 4-[(2-fluoroethyl)thio]-2,5-dimethoxy- [ACD/Index Name]
2,5-DIMETHOXY-4-(2-FLUOROETHYLTHIO)PHENETHYLAMINE
2-[4-(2-Fluoro-ethylsulfanyl)-2,5-dimethoxy-phenyl]-ethylamine
UNII-720O3Q04GA

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 379.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 62.7±3.0 kJ/mol
Flash Point: 183.1±27.9 °C
Index of Refraction: 1.539
Molar Refractivity: 69.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.99
ACD/LogD (pH 5.5): -1.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.99
Polar Surface Area: 70 Å2
Polarizability: 27.7±0.5 10-24cm3
Surface Tension: 43.1±5.0 dyne/cm
Molar Volume: 222.8±5.0 cm3

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