ChemSpider 2D Image | 6-(Ethylamino)-3-(isopropylamino)-1,2,4-triazine-5(2H)-thione | C8H15N5S

6-(Ethylamino)-3-(isopropylamino)-1,2,4-triazine-5(2H)-thione

  • Molecular FormulaC8H15N5S
  • Average mass213.303 Da
  • Monoisotopic mass213.104813 Da
  • ChemSpider ID25988092

More details:

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

1,2,4-Triazine-5(4H)-thione, 6-(ethylamino)-3-[(1-methylethyl)amino]- [ACD/Index Name]
6-(Ethylamino)-3-(isopropylamino)-1,2,4-triazin-5(2H)-thion [German] [ACD/IUPAC Name]
6-(Ethylamino)-3-(isopropylamino)-1,2,4-triazine-5(2H)-thione [ACD/IUPAC Name]
6-(Éthylamino)-3-(isopropylamino)-1,2,4-triazine-5(2H)-thione [French] [ACD/IUPAC Name]
1206097-43-9 [RN]
6-(ethylamino)-3-(propan-2-ylamino)-1,2,4-triazine-5(4H)-thione
6-Ethylamino-3-isopropylamino-4H-[1,2,4]triazine-5-thione

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

Density: 1.3±0.1 g/cm3
Boiling Point: 285.2±23.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.6 mmHg at 25°C
Enthalpy of Vaporization: 52.4±3.0 kJ/mol
Flash Point: 126.3±22.6 °C
Index of Refraction: 1.645
Molar Refractivity: 58.9±0.5 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: -0.27
ACD/LogD (pH 5.5): 0.24
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 30.17
ACD/LogD (pH 7.4): -0.71
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.33
Polar Surface Area: 93 Å2
Polarizability: 23.4±0.5 10-24cm3
Surface Tension: 41.9±7.0 dyne/cm
Molar Volume: 162.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement