Found 45 results

Search term: MF = 'C_{11}H_{9}F_{2}N_{5}OS'
ChemSpider 2D Image | 5-({[1-(Difluoromethyl)-1H-benzimidazol-2-yl]methyl}sulfanyl)-4H-1,2,4-triazol-3-ol | C11H9F2N5OS

5-({[1-(Difluoromethyl)-1H-benzimidazol-2-yl]methyl}sulfanyl)-4H-1,2,4-triazol-3-ol

  • Molecular FormulaC11H9F2N5OS
  • Average mass297.284 Da
  • Monoisotopic mass297.049591 Da
  • ChemSpider ID65271976

More details:

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

4H-1,2,4-Triazol-3-ol, 5-[[[1-(difluoromethyl)-1H-benzimidazol-2-yl]methyl]thio]- [ACD/Index Name]
5-({[1-(Difluormethyl)-1H-benzimidazol-2-yl]methyl}sulfanyl)-4H-1,2,4-triazol-3-ol [German] [ACD/IUPAC Name]
5-({[1-(Difluoromethyl)-1H-benzimidazol-2-yl]methyl}sulfanyl)-4H-1,2,4-triazol-3-ol [ACD/IUPAC Name]
5-({[1-(Difluorométhyl)-1H-benzimidazol-2-yl]méthyl}sulfanyl)-4H-1,2,4-triazol-3-ol [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 579.0±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.8±3.0 kJ/mol
Flash Point: 303.9±32.9 °C
Index of Refraction: 1.755
Molar Refractivity: 70.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.08
ACD/LogD (pH 5.5): 1.71
ACD/BCF (pH 5.5): 11.27
ACD/KOC (pH 5.5): 188.12
ACD/LogD (pH 7.4): 0.79
ACD/BCF (pH 7.4): 1.36
ACD/KOC (pH 7.4): 22.76
Polar Surface Area: 105 Å2
Polarizability: 27.8±0.5 10-24cm3
Surface Tension: 63.2±7.0 dyne/cm
Molar Volume: 171.4±7.0 cm3

Click to predict properties on the Chemicalize site


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