ChemSpider 2D Image | N-[2-(3-Isopropyl-4H-1,2,4-triazol-4-yl)ethyl]-3-methyl-1,2,4-thiadiazol-5-amine | C10H16N6S

N-[2-(3-Isopropyl-4H-1,2,4-triazol-4-yl)ethyl]-3-methyl-1,2,4-thiadiazol-5-amine

  • Molecular FormulaC10H16N6S
  • Average mass252.339 Da
  • Monoisotopic mass252.115707 Da
  • ChemSpider ID35157734

More details:

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

1,2,4-Thiadiazol-5-amine, 3-methyl-N-[2-[3-(1-methylethyl)-4H-1,2,4-triazol-4-yl]ethyl]- [ACD/Index Name]
N-[2-(3-Isopropyl-4H-1,2,4-triazol-4-yl)ethyl]-3-methyl-1,2,4-thiadiazol-5-amin [German] [ACD/IUPAC Name]
N-[2-(3-Isopropyl-4H-1,2,4-triazol-4-yl)ethyl]-3-methyl-1,2,4-thiadiazol-5-amine [ACD/IUPAC Name]
N-[2-(3-Isopropyl-4H-1,2,4-triazol-4-yl)éthyl]-3-méthyl-1,2,4-thiadiazol-5-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: 452.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 71.1±3.0 kJ/mol
Flash Point: 227.2±31.5 °C
Index of Refraction: 1.692
Molar Refractivity: 70.0±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 0.54
ACD/LogD (pH 5.5): 1.18
ACD/BCF (pH 5.5): 4.61
ACD/KOC (pH 5.5): 103.47
ACD/LogD (pH 7.4): 1.18
ACD/BCF (pH 7.4): 4.67
ACD/KOC (pH 7.4): 104.83
Polar Surface Area: 97 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 51.9±7.0 dyne/cm
Molar Volume: 182.9±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement