ChemSpider 2D Image | 5-(2-Methyl-2-propanyl)-N-[3-(tetrahydro-2H-pyran-4-ylmethoxy)propyl]-1,3,4-thiadiazol-2-amine | C15H27N3O2S

5-(2-Methyl-2-propanyl)-N-[3-(tetrahydro-2H-pyran-4-ylmethoxy)propyl]-1,3,4-thiadiazol-2-amine

  • Molecular FormulaC15H27N3O2S
  • Average mass313.459 Da
  • Monoisotopic mass313.182404 Da
  • ChemSpider ID30382726

More details:

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

1,3,4-Thiadiazol-2-amine, 5-(1,1-dimethylethyl)-N-[3-[(tetrahydro-2H-pyran-4-yl)methoxy]propyl]- [ACD/Index Name]
5-(2-Methyl-2-propanyl)-N-[3-(tetrahydro-2H-pyran-4-ylmethoxy)propyl]-1,3,4-thiadiazol-2-amin [German] [ACD/IUPAC Name]
5-(2-Methyl-2-propanyl)-N-[3-(tetrahydro-2H-pyran-4-ylmethoxy)propyl]-1,3,4-thiadiazol-2-amine [ACD/IUPAC Name]
5-(2-Méthyl-2-propanyl)-N-[3-(tétrahydro-2H-pyran-4-ylméthoxy)propyl]-1,3,4-thiadiazol-2-amine [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: 441.7±51.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 69.9±3.0 kJ/mol
Flash Point: 220.9±30.4 °C
Index of Refraction: 1.533
Molar Refractivity: 87.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.07
ACD/LogD (pH 5.5): 2.38
ACD/BCF (pH 5.5): 38.14
ACD/KOC (pH 5.5): 469.93
ACD/LogD (pH 7.4): 2.39
ACD/BCF (pH 7.4): 38.62
ACD/KOC (pH 7.4): 475.81
Polar Surface Area: 85 Å2
Polarizability: 34.5±0.5 10-24cm3
Surface Tension: 43.6±3.0 dyne/cm
Molar Volume: 280.9±3.0 cm3

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