ChemSpider 2D Image | 2C-T-16 | C13H19NO2S

2C-T-16

  • Molecular FormulaC13H19NO2S
  • Average mass253.361 Da
  • Monoisotopic mass253.113647 Da
  • ChemSpider ID58191439

More details:

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

2,5-Dimethoxy-4-(2-propen-1-ylthio)benzeneethanamine
2-[4-(Allylsulfanyl)-2,5-dimethoxyphenyl]ethanamin [German] [ACD/IUPAC Name]
2-[4-(Allylsulfanyl)-2,5-dimethoxyphenyl]ethanamine [ACD/IUPAC Name]
2-[4-(Allylsulfanyl)-2,5-diméthoxyphényl]éthanamine [French] [ACD/IUPAC Name]
2C-T-16 [Wiki]
748131-14-8 [RN]
Benzeneethanamine, 2,5-dimethoxy-4-(2-propen-1-ylthio)- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 365.2±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 61.2±3.0 kJ/mol
Flash Point: 174.7±27.9 °C
Index of Refraction: 1.559
Molar Refractivity: 74.0±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.67
ACD/LogD (pH 5.5): -0.45
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.52
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.18
Polar Surface Area: 70 Å2
Polarizability: 29.3±0.5 10-24cm3
Surface Tension: 44.1±5.0 dyne/cm
Molar Volume: 229.3±5.0 cm3

Click to predict properties on the Chemicalize site


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