Found 178 results

Search term: MF = 'C_{17}H_{21}F_{3}N_{4}OS'
ChemSpider 2D Image | 1-(2,4-Dimethylphenyl)-2-{4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1-piperazinyl}ethanol | C17H21F3N4OS

1-(2,4-Dimethylphenyl)-2-{4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1-piperazinyl}ethanol

  • Molecular FormulaC17H21F3N4OS
  • Average mass386.435 Da
  • Monoisotopic mass386.138824 Da
  • ChemSpider ID22514018

More details:

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

1-(2,4-Dimethylphenyl)-2-{4-[5-(trifluormethyl)-1,3,4-thiadiazol-2-yl]-1-piperazinyl}ethanol [German] [ACD/IUPAC Name]
1-(2,4-Dimethylphenyl)-2-{4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1-piperazinyl}ethanol [ACD/IUPAC Name]
1-(2,4-Diméthylphényl)-2-{4-[5-(trifluorométhyl)-1,3,4-thiadiazol-2-yl]-1-pipérazinyl}éthanol [French] [ACD/IUPAC Name]
1-Piperazineethanol, α-(2,4-dimethylphenyl)-4-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 475.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 77.8±3.0 kJ/mol
Flash Point: 241.2±31.5 °C
Index of Refraction: 1.563
Molar Refractivity: 94.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.06
ACD/LogD (pH 5.5): 1.22
ACD/BCF (pH 5.5): 2.45
ACD/KOC (pH 5.5): 28.28
ACD/LogD (pH 7.4): 2.42
ACD/BCF (pH 7.4): 38.99
ACD/KOC (pH 7.4): 450.74
Polar Surface Area: 81 Å2
Polarizability: 37.5±0.5 10-24cm3
Surface Tension: 49.0±3.0 dyne/cm
Molar Volume: 291.3±3.0 cm3

Click to predict properties on the Chemicalize site


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