Found 34 results

Search term: MF = 'C_{9}H_{6}F_{3}N_{3}S_{2}'
ChemSpider 2D Image | 3-{4-[(Trifluoromethyl)sulfanyl]phenyl}-1,2,4-thiadiazol-5-amine | C9H6F3N3S2

3-{4-[(Trifluoromethyl)sulfanyl]phenyl}-1,2,4-thiadiazol-5-amine

  • Molecular FormulaC9H6F3N3S2
  • Average mass277.289 Da
  • Monoisotopic mass276.995514 Da
  • ChemSpider ID33350847

More details:

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

1,2,4-Thiadiazol-5-amine, 3-[4-[(trifluoromethyl)thio]phenyl]- [ACD/Index Name]
3-{4-[(Trifluormethyl)sulfanyl]phenyl}-1,2,4-thiadiazol-5-amin [German] [ACD/IUPAC Name]
3-{4-[(Trifluoromethyl)sulfanyl]phenyl}-1,2,4-thiadiazol-5-amine [ACD/IUPAC Name]
3-{4-[(Trifluorométhyl)sulfanyl]phényl}-1,2,4-thiadiazol-5-amine [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 328.4±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 57.1±3.0 kJ/mol
Flash Point: 152.4±30.7 °C
Index of Refraction: 1.622
Molar Refractivity: 61.8±0.4 cm3
#H bond acceptors: 3
#H bond donors: 2
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.74
ACD/LogD (pH 5.5): 3.06
ACD/BCF (pH 5.5): 125.08
ACD/KOC (pH 5.5): 1103.36
ACD/LogD (pH 7.4): 3.06
ACD/BCF (pH 7.4): 125.15
ACD/KOC (pH 7.4): 1103.98
Polar Surface Area: 105 Å2
Polarizability: 24.5±0.5 10-24cm3
Surface Tension: 63.7±5.0 dyne/cm
Molar Volume: 175.5±5.0 cm3

Click to predict properties on the Chemicalize site


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