ChemSpider 2D Image | 4-Amino-6-(benzylsulfanyl)-1,3,5-triazin-2(1H)-one | C10H10N4OS

4-Amino-6-(benzylsulfanyl)-1,3,5-triazin-2(1H)-one

  • Molecular FormulaC10H10N4OS
  • Average mass234.278 Da
  • Monoisotopic mass234.057526 Da
  • ChemSpider ID26457681

More details:

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

1,3,5-Triazin-2(5H)-one, 4-amino-6-[(phenylmethyl)thio]- [ACD/Index Name]
4-Amino-6-(benzylsulfanyl)-1,3,5-triazin-2(1H)-on [German] [ACD/IUPAC Name]
4-Amino-6-(benzylsulfanyl)-1,3,5-triazin-2(1H)-one [ACD/IUPAC Name]
4-Amino-6-(benzylsulfanyl)-1,3,5-triazin-2(1H)-one [French] [ACD/IUPAC Name]
4-amino-6-(benzylsulfanyl)-2,5-dihydro-1,3,5-triazin-2-one
56864-83-6 [RN]
1,3,5-triazin-2(1H)-one, 6-amino-4-[(phenylmethyl)thio]-
1,3,5-triazin-2(5H)-one, 4-amino-6-[(phenylmethyl)thio]
4-amino-6-(benzylthio)-1,3,5-triazin-2(5H)-one
4-Amino-6-benzylsulfanyl-5H-[1,3,5]triazin-2-one
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 399.1±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 65.0±3.0 kJ/mol
    Flash Point: 195.2±25.9 °C
    Index of Refraction: 1.725
    Molar Refractivity: 63.3±0.5 cm3
    #H bond acceptors: 5
    #H bond donors: 3
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 0.37
    ACD/LogD (pH 5.5): 0.40
    ACD/BCF (pH 5.5): 1.04
    ACD/KOC (pH 5.5): 30.17
    ACD/LogD (pH 7.4): -0.94
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.36
    Polar Surface Area: 105 Å2
    Polarizability: 25.1±0.5 10-24cm3
    Surface Tension: 65.1±7.0 dyne/cm
    Molar Volume: 159.3±7.0 cm3

    Click to predict properties on the Chemicalize site


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