Found 232 results

Search term: MF = 'C_{16}H_{19}Cl_{2}N_{3}OS'
ChemSpider 2D Image | 1-(3,4-Dichlorophenyl)-5-[2-(methylsulfanyl)ethyl]-3-(tetrahydro-2H-pyran-4-yl)-1H-1,2,4-triazole | C16H19Cl2N3OS

1-(3,4-Dichlorophenyl)-5-[2-(methylsulfanyl)ethyl]-3-(tetrahydro-2H-pyran-4-yl)-1H-1,2,4-triazole

  • Molecular FormulaC16H19Cl2N3OS
  • Average mass372.313 Da
  • Monoisotopic mass371.062592 Da
  • ChemSpider ID30942051

More details:

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

1-(3,4-Dichlorophenyl)-5-[2-(methylsulfanyl)ethyl]-3-(tetrahydro-2H-pyran-4-yl)-1H-1,2,4-triazole [ACD/IUPAC Name]
1-(3,4-Dichlorophényl)-5-[2-(méthylsulfanyl)éthyl]-3-(tétrahydro-2H-pyran-4-yl)-1H-1,2,4-triazole [French] [ACD/IUPAC Name]
1-(3,4-Dichlorphenyl)-5-[2-(methylsulfanyl)ethyl]-3-(tetrahydro-2H-pyran-4-yl)-1H-1,2,4-triazol [German] [ACD/IUPAC Name]
1H-1,2,4-Triazole, 1-(3,4-dichlorophenyl)-5-[2-(methylthio)ethyl]-3-(tetrahydro-2H-pyran-4-yl)- [ACD/Index Name]
1-(3,4-dichlorophenyl)-5-[2-(methylthio)ethyl]-3-(tetrahydro-2H-pyran-4-yl)-1H-1,2,4-triazole

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

Density: 1.4±0.1 g/cm3
Boiling Point: 559.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 84.2±3.0 kJ/mol
Flash Point: 292.3±32.9 °C
Index of Refraction: 1.657
Molar Refractivity: 96.9±0.5 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.92
ACD/LogD (pH 5.5): 4.69
ACD/BCF (pH 5.5): 2172.48
ACD/KOC (pH 5.5): 8514.84
ACD/LogD (pH 7.4): 4.69
ACD/BCF (pH 7.4): 2172.70
ACD/KOC (pH 7.4): 8515.71
Polar Surface Area: 65 Å2
Polarizability: 38.4±0.5 10-24cm3
Surface Tension: 49.8±7.0 dyne/cm
Molar Volume: 263.6±7.0 cm3

Click to predict properties on the Chemicalize site


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