ChemSpider 2D Image | N-[(4-Methyl-3-thienyl)methyl]tetrahydro-2H-thiopyran-4-amine | C11H17NS2

N-[(4-Methyl-3-thienyl)methyl]tetrahydro-2H-thiopyran-4-amine

  • Molecular FormulaC11H17NS2
  • Average mass227.389 Da
  • Monoisotopic mass227.080246 Da
  • ChemSpider ID36785259

More details:

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

2H-Thiopyran-4-amine, tetrahydro-N-[(4-methyl-3-thienyl)methyl]- [ACD/Index Name]
N-[(4-Methyl-3-thienyl)methyl]tetrahydro-2H-thiopyran-4-amin [German] [ACD/IUPAC Name]
N-[(4-Methyl-3-thienyl)methyl]tetrahydro-2H-thiopyran-4-amine [ACD/IUPAC Name]
N-[(4-Méthyl-3-thiényl)méthyl]tétrahydro-2H-thiopyrane-4-amine [French] [ACD/IUPAC Name]
1514408-43-5 [RN]
MFCD23859463

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

Density: 1.1±0.1 g/cm3
Boiling Point: 356.3±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.2±3.0 kJ/mol
Flash Point: 169.3±27.9 °C
Index of Refraction: 1.590
Molar Refractivity: 66.9±0.4 cm3
#H bond acceptors: 1
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.75
ACD/LogD (pH 5.5): 0.26
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.53
ACD/LogD (pH 7.4): 1.67
ACD/BCF (pH 7.4): 4.75
ACD/KOC (pH 7.4): 39.35
Polar Surface Area: 66 Å2
Polarizability: 26.5±0.5 10-24cm3
Surface Tension: 45.9±5.0 dyne/cm
Molar Volume: 198.3±5.0 cm3

Click to predict properties on the Chemicalize site


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