ChemSpider 2D Image | 4-[(3-Methylbutyl)sulfanyl]-1,3,5-triazin-2-amine | C8H14N4S

4-[(3-Methylbutyl)sulfanyl]-1,3,5-triazin-2-amine

  • Molecular FormulaC8H14N4S
  • Average mass198.289 Da
  • Monoisotopic mass198.093918 Da
  • ChemSpider ID23364790

More details:






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

1,3,5-Triazin-2-amine, 4-[(3-methylbutyl)thio]- [ACD/Index Name]
4-[(3-Methylbutyl)sulfanyl]-1,3,5-triazin-2-amin [German] [ACD/IUPAC Name]
4-[(3-Methylbutyl)sulfanyl]-1,3,5-triazin-2-amine [ACD/IUPAC Name]
4-[(3-Méthylbutyl)sulfanyl]-1,3,5-triazin-2-amine [French] [ACD/IUPAC Name]
4-(3-Methyl-butylsulfanyl)-[1,3,5]triazin-2-ylamine
4-(3-methylbutylthio)-1,3,5-triazine-2-ylamine
4-[(3-methylbutyl)thio]-1,3,5-triazin-2-amine

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 392.0±25.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.9 mmHg at 25°C
Enthalpy of Vaporization: 64.2±3.0 kJ/mol
Flash Point: 190.9±23.2 °C
Index of Refraction: 1.563
Molar Refractivity: 54.9±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 1.18
ACD/LogD (pH 5.5): 1.66
ACD/BCF (pH 5.5): 10.66
ACD/KOC (pH 5.5): 189.18
ACD/LogD (pH 7.4): 1.66
ACD/BCF (pH 7.4): 10.71
ACD/KOC (pH 7.4): 190.01
Polar Surface Area: 90 Å2
Polarizability: 21.8±0.5 10-24cm3
Surface Tension: 59.3±5.0 dyne/cm
Molar Volume: 168.9±5.0 cm3

Click to predict properties on the Chemicalize site






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