ChemSpider 2D Image | Methyl 4,5-dibromo-3-fluoro-2-thiophenecarboxylate | C6H3Br2FO2S

Methyl 4,5-dibromo-3-fluoro-2-thiophenecarboxylate

  • Molecular FormulaC6H3Br2FO2S
  • Average mass317.958 Da
  • Monoisotopic mass315.820435 Da
  • ChemSpider ID23346628

More details:

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

2-Thiophenecarboxylic acid, 4,5-dibromo-3-fluoro-, methyl ester [ACD/Index Name]
395664-58-1 [RN]
4,5-Dibromo-3-fluoro-2-thiophènecarboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 4,5-dibromo-3-fluoro-2-thiophenecarboxylate [ACD/IUPAC Name]
methyl 4,5-dibromo-3-fluorothiophene-2-carboxylate
Methyl-4,5-dibrom-3-fluor-2-thiophencarboxylat [German] [ACD/IUPAC Name]
[395664-58-1] [RN]
2-Thiophenecarboxylic acid,4,5-dibromo-3-fluoro-,methyl ester
2-THIOPHENECARBOXYLICACID, 4,5-DIBROMO-3-FLUORO-, METHYL ESTER
2-Thiophenecarboxylicacid,4,5-dibromo-3-fluoro-,methyl ester
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 2.1±0.1 g/cm3
    Boiling Point: 311.6±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.7 mmHg at 25°C
    Enthalpy of Vaporization: 55.3±3.0 kJ/mol
    Flash Point: 142.2±27.9 °C
    Index of Refraction: 1.590
    Molar Refractivity: 51.8±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 2.71
    ACD/LogD (pH 5.5): 3.39
    ACD/BCF (pH 5.5): 223.12
    ACD/KOC (pH 5.5): 1669.88
    ACD/LogD (pH 7.4): 3.39
    ACD/BCF (pH 7.4): 223.12
    ACD/KOC (pH 7.4): 1669.88
    Polar Surface Area: 55 Å2
    Polarizability: 20.5±0.5 10-24cm3
    Surface Tension: 47.8±3.0 dyne/cm
    Molar Volume: 153.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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