ChemSpider 2D Image | Methyl 3-(2-methoxyethoxy)-5-nitro-2-thiophenecarboxylate | C9H11NO6S

Methyl 3-(2-methoxyethoxy)-5-nitro-2-thiophenecarboxylate

  • Molecular FormulaC9H11NO6S
  • Average mass261.252 Da
  • Monoisotopic mass261.030701 Da
  • ChemSpider ID35492448

More details:

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

2-Thiophenecarboxylic acid, 3-(2-methoxyethoxy)-5-nitro-, methyl ester [ACD/Index Name]
3-(2-Méthoxyéthoxy)-5-nitro-2-thiophènecarboxylate de méthyle [French] [ACD/IUPAC Name]
Methyl 3-(2-methoxyethoxy)-5-nitro-2-thiophenecarboxylate [ACD/IUPAC Name]
Methyl-3-(2-methoxyethoxy)-5-nitro-2-thiophencarboxylat [German] [ACD/IUPAC Name]
1707581-79-0 [RN]
3-(2-Methoxy-ethoxy)-5-nitro-thiophene-2-carboxylic acid methyl ester
methyl 3-(2-methoxyethoxy)-5-nitrothiophene-2-carboxylate
MFCD26129661

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 396.9±42.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 64.7±3.0 kJ/mol
    Flash Point: 193.9±27.9 °C
    Index of Refraction: 1.544
    Molar Refractivity: 60.6±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 1.26
    ACD/LogD (pH 5.5): 1.70
    ACD/BCF (pH 5.5): 11.58
    ACD/KOC (pH 5.5): 200.96
    ACD/LogD (pH 7.4): 1.70
    ACD/BCF (pH 7.4): 11.58
    ACD/KOC (pH 7.4): 200.96
    Polar Surface Area: 119 Å2
    Polarizability: 24.0±0.5 10-24cm3
    Surface Tension: 48.5±3.0 dyne/cm
    Molar Volume: 192.0±3.0 cm3

    Click to predict properties on the Chemicalize site


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