ChemSpider 2D Image | N-[(5-Methyl-2-thienyl)methyl]-5-[3-(trifluoromethyl)phenyl]-1,2,4-triazin-3-amine | C16H13F3N4S

N-[(5-Methyl-2-thienyl)methyl]-5-[3-(trifluoromethyl)phenyl]-1,2,4-triazin-3-amine

  • Molecular FormulaC16H13F3N4S
  • Average mass350.361 Da
  • Monoisotopic mass350.081299 Da
  • ChemSpider ID22175850

More details:

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

1,2,4-Triazin-3-amine, N-[(5-methyl-2-thienyl)methyl]-5-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
N-[(5-Methyl-2-thienyl)methyl]-5-[3-(trifluormethyl)phenyl]-1,2,4-triazin-3-amin [German] [ACD/IUPAC Name]
N-[(5-Methyl-2-thienyl)methyl]-5-[3-(trifluoromethyl)phenyl]-1,2,4-triazin-3-amine [ACD/IUPAC Name]
N-[(5-Méthyl-2-thiényl)méthyl]-5-[3-(trifluorométhyl)phényl]-1,2,4-triazin-3-amine [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 505.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 77.5±3.0 kJ/mol
Flash Point: 259.4±32.9 °C
Index of Refraction: 1.605
Molar Refractivity: 87.4±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.41
ACD/LogD (pH 5.5): 4.25
ACD/BCF (pH 5.5): 993.86
ACD/KOC (pH 5.5): 4863.84
ACD/LogD (pH 7.4): 4.25
ACD/BCF (pH 7.4): 994.71
ACD/KOC (pH 7.4): 4868.01
Polar Surface Area: 79 Å2
Polarizability: 34.7±0.5 10-24cm3
Surface Tension: 49.2±3.0 dyne/cm
Molar Volume: 253.8±3.0 cm3

Click to predict properties on the Chemicalize site


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