ChemSpider 2D Image | N-[(2-Methyltetrahydro-2-thiophenyl)methyl]-1-(3-thienyl)ethanamine | C12H19NS2

N-[(2-Methyltetrahydro-2-thiophenyl)methyl]-1-(3-thienyl)ethanamine

  • Molecular FormulaC12H19NS2
  • Average mass241.416 Da
  • Monoisotopic mass241.095886 Da
  • ChemSpider ID36352893

More details:

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

2-Thiophenemethanamine, tetrahydro-2-methyl-N-[1-(3-thienyl)ethyl]- [ACD/Index Name]
N-[(2-Methyltetrahydro-2-thiophenyl)methyl]-1-(3-thienyl)ethanamin [German] [ACD/IUPAC Name]
N-[(2-Methyltetrahydro-2-thiophenyl)methyl]-1-(3-thienyl)ethanamine [ACD/IUPAC Name]
N-[(2-Méthyltétrahydro-2-thiophényl)méthyl]-1-(3-thiényl)éthanamine [French] [ACD/IUPAC 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: 343.4±17.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 58.7±3.0 kJ/mol
Flash Point: 161.5±20.9 °C
Index of Refraction: 1.564
Molar Refractivity: 71.7±0.3 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.08
ACD/LogD (pH 5.5): 0.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.66
ACD/LogD (pH 7.4): 2.17
ACD/BCF (pH 7.4): 12.89
ACD/KOC (pH 7.4): 93.47
Polar Surface Area: 66 Å2
Polarizability: 28.4±0.5 10-24cm3
Surface Tension: 43.2±3.0 dyne/cm
Molar Volume: 220.4±3.0 cm3

Click to predict properties on the Chemicalize site


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