ChemSpider 2D Image | Methyl 2-(3-(trifluoromethyl)phenyl)thiazole-5-carboxylate | C12H8F3NO2S

Methyl 2-(3-(trifluoromethyl)phenyl)thiazole-5-carboxylate

  • Molecular FormulaC12H8F3NO2S
  • Average mass287.258 Da
  • Monoisotopic mass287.022797 Da
  • ChemSpider ID24723556

More details:

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

1018975-69-3 [RN]
2-[3-(Trifluorométhyl)phényl]-1,3-thiazole-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
5-Thiazolecarboxylic acid, 2-[3-(trifluoromethyl)phenyl]-, methyl ester [ACD/Index Name]
Methyl 2-(3-(trifluoromethyl)phenyl)thiazole-5-carboxylate
Methyl 2-[3-(trifluoromethyl)phenyl]-1,3-thiazole-5-carboxylate [ACD/IUPAC Name]
Methyl-2-[3-(trifluormethyl)phenyl]-1,3-thiazol-5-carboxylat [German] [ACD/IUPAC Name]
[1018975-69-3] [RN]
2-(3-Trifluoromethylphenyl)thiazole-5-carboxylic acid methyl ester
2-(3-Trifluoromethylphenyl)-thiazole-5-carboxylic acid methyl ester
2-(3-Trifluoromethyl-phenyl)-thiazole-5-carboxylic acid methyl ester
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.4±0.1 g/cm3
Boiling Point: 359.0±52.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.8 mmHg at 25°C
Enthalpy of Vaporization: 60.5±3.0 kJ/mol
Flash Point: 170.9±30.7 °C
Index of Refraction: 1.526
Molar Refractivity: 64.1±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.27
ACD/LogD (pH 5.5): 3.47
ACD/BCF (pH 5.5): 255.67
ACD/KOC (pH 5.5): 1840.89
ACD/LogD (pH 7.4): 3.47
ACD/BCF (pH 7.4): 255.68
ACD/KOC (pH 7.4): 1840.90
Polar Surface Area: 67 Å2
Polarizability: 25.4±0.5 10-24cm3
Surface Tension: 38.4±3.0 dyne/cm
Molar Volume: 208.8±3.0 cm3

Click to predict properties on the Chemicalize site


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