ChemSpider 2D Image | 3-({2-[4-(Trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methyl)-1,3-benzoxazol-2(3H)-one | C18H11F3N2O2S

3-({2-[4-(Trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methyl)-1,3-benzoxazol-2(3H)-one

  • Molecular FormulaC18H11F3N2O2S
  • Average mass376.352 Da
  • Monoisotopic mass376.049347 Da
  • ChemSpider ID30049507

More details:

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

2(3H)-Benzoxazolone, 3-[[2-[4-(trifluoromethyl)phenyl]-4-thiazolyl]methyl]- [ACD/Index Name]
3-({2-[4-(Trifluormethyl)phenyl]-1,3-thiazol-4-yl}methyl)-1,3-benzoxazol-2(3H)-on [German] [ACD/IUPAC Name]
3-({2-[4-(Trifluoromethyl)phenyl]-1,3-thiazol-4-yl}methyl)-1,3-benzoxazol-2(3H)-one [ACD/IUPAC Name]
3-({2-[4-(Trifluorométhyl)phényl]-1,3-thiazol-4-yl}méthyl)-1,3-benzoxazol-2(3H)-one [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 497.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.3 mmHg at 25°C
Enthalpy of Vaporization: 76.6±3.0 kJ/mol
Flash Point: 254.7±31.5 °C
Index of Refraction: 1.615
Molar Refractivity: 89.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.95
ACD/LogD (pH 5.5): 4.34
ACD/BCF (pH 5.5): 1164.65
ACD/KOC (pH 5.5): 5449.79
ACD/LogD (pH 7.4): 4.34
ACD/BCF (pH 7.4): 1164.66
ACD/KOC (pH 7.4): 5449.87
Polar Surface Area: 71 Å2
Polarizability: 35.6±0.5 10-24cm3
Surface Tension: 52.8±3.0 dyne/cm
Molar Volume: 256.9±3.0 cm3

Click to predict properties on the Chemicalize site


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