ChemSpider 2D Image | 2-[4-(tert-butylsulfanyl)-2,5-dimethoxyphenyl]ethanamine | C14H23NO2S

2-[4-(tert-butylsulfanyl)-2,5-dimethoxyphenyl]ethanamine

  • Molecular FormulaC14H23NO2S
  • Average mass269.403 Da
  • Monoisotopic mass269.144958 Da
  • ChemSpider ID23206245

More details:

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

2-[4-(tert-butylsulfanyl)-2,5-dimethoxyphenyl]ethanamine
2-{2,5-Dimethoxy-4-[(2-methyl-2-propanyl)sulfanyl]phenyl}ethanamin [German] [ACD/IUPAC Name]
2-{2,5-Dimethoxy-4-[(2-methyl-2-propanyl)sulfanyl]phenyl}ethanamine [ACD/IUPAC Name]
2-{2,5-Diméthoxy-4-[(2-méthyl-2-propanyl)sulfanyl]phényl}éthanamine [French] [ACD/IUPAC Name]
Benzeneethanamine, 4-[(1,1-dimethylethyl)thio]-2,5-dimethoxy- [ACD/Index Name]
2-(4-tert-Butylsulfanyl-2,5-dimethoxy-phenyl)-ethylamine

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

Density: 1.1±0.1 g/cm3
Boiling Point: 379.5±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: 183.3±27.9 °C
Index of Refraction: 1.542
Molar Refractivity: 78.9±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.09
ACD/LogD (pH 5.5): 0.17
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.20
ACD/LogD (pH 7.4): 1.13
ACD/BCF (pH 7.4): 1.35
ACD/KOC (pH 7.4): 11.00
Polar Surface Area: 70 Å2
Polarizability: 31.3±0.5 10-24cm3
Surface Tension: 41.9±5.0 dyne/cm
Molar Volume: 250.7±5.0 cm3

Click to predict properties on the Chemicalize site


Advertisement