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Search term: HBIZLJRVCDTEIZ (Found by InChIKey (skeleton match))

ChemSpider 2D Image | Ethyl 3-(trifluoromethyl)-2-quinoxalinecarboxylate | C12H9F3N2O2

Ethyl 3-(trifluoromethyl)-2-quinoxalinecarboxylate

  • Molecular FormulaC12H9F3N2O2
  • Average mass270.207 Da
  • Monoisotopic mass270.061615 Da
  • ChemSpider ID21541398

More details:






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

2-Quinoxalinecarboxylic acid, 3-(trifluoromethyl)-, ethyl ester [ACD/Index Name]
3-(Trifluorométhyl)-2-quinoxalinecarboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 3-(trifluoromethyl)-2-quinoxalinecarboxylate [ACD/IUPAC Name]
Ethyl-3-(trifluormethyl)-2-chinoxalincarboxylat [German] [ACD/IUPAC Name]
[3885-40-3]
2-(Ethoxycarbonyl)-3-(trifluoromethyl)-1,4-benzodiazine
2-(Ethoxycarbonyl)-3-(trifluoromethyl)quinoxaline
2-(Ethoxycarbonyl)-3-(trifluoromethyl)quinoxaline, 2-(Ethoxycarbonyl)-3-(trifluoromethyl)-1,4-benzodiazine
2-(Ethoxycarbonyl)-3-(trifluoromethyl)quinoxaline; 2-(Ethoxycarbonyl)-3-(trifluoromethyl)-1,4-benzodiazine
3885-40-3 [RN]
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 325.8±42.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.7 mmHg at 25°C
Enthalpy of Vaporization: 56.8±3.0 kJ/mol
Flash Point: 150.8±27.9 °C
Index of Refraction: 1.536
Molar Refractivity: 61.7±0.3 cm3
#H bond acceptors: 4
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 4.14
ACD/LogD (pH 5.5): 3.44
ACD/BCF (pH 5.5): 240.74
ACD/KOC (pH 5.5): 1763.26
ACD/LogD (pH 7.4): 3.44
ACD/BCF (pH 7.4): 240.74
ACD/KOC (pH 7.4): 1763.26
Polar Surface Area: 52 Å2
Polarizability: 24.4±0.5 10-24cm3
Surface Tension: 41.1±3.0 dyne/cm
Molar Volume: 197.9±3.0 cm3

Click to predict properties on the Chemicalize site






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