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Search term: Ethyl 2-(4-chlorophenylamino)-4,9-dioxo-4,9-dihydronaphtho[2,3-b]thiophene-3-carboxylate (Found by synonym)
ChemSpider 2D Image | Ethyl 2-[(4-chlorophenyl)amino]-4,9-dioxo-4,9-dihydronaphtho[2,3-b]thiophene-3-carboxylate | C21H14ClNO4S

Ethyl 2-[(4-chlorophenyl)amino]-4,9-dioxo-4,9-dihydronaphtho[2,3-b]thiophene-3-carboxylate

  • Molecular FormulaC21H14ClNO4S
  • Average mass411.858 Da
  • Monoisotopic mass411.033203 Da
  • ChemSpider ID26233832

More details:

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

1258638-44-6 [RN]
2-[(4-Chlorophényl)amino]-4,9-dioxo-4,9-dihydronaphto[2,3-b]thiophène-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
Ethyl 2-[(4-chlorophenyl)amino]-4,9-dioxo-4,9-dihydronaphtho[2,3-b]thiophene-3-carboxylate [ACD/IUPAC Name]
Ethyl-2-[(4-chlorphenyl)amino]-4,9-dioxo-4,9-dihydronaphtho[2,3-b]thiophen-3-carboxylat [German] [ACD/IUPAC Name]
Naphtho[2,3-b]thiophene-3-carboxylic acid, 2-[(4-chlorophenyl)amino]-4,9-dihydro-4,9-dioxo-, ethyl ester [ACD/Index Name]
[1258638-44-6] [RN]
125863-84-5 [RN]
Ethyl 2-((4-chlorophenyl)amino)-4,9-dioxo-4,9-dihydronaphtho[2,3-b]thiophene-3-carboxylate
Ethyl 2-(4-chloroanilino)-4,9-dioxo-4,9-dihydronaphtho[2,3-b]thiophene-3-carboxylate
ethyl 2-(4-chloroanilino)-4,9-dioxobenzo[f][1]benzothiole-3-carboxylate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 626.5±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 92.7±3.0 kJ/mol
    Flash Point: 332.7±31.5 °C
    Index of Refraction: 1.693
    Molar Refractivity: 107.7±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 1
    ACD/LogP: 7.07
    ACD/LogD (pH 5.5): 5.53
    ACD/BCF (pH 5.5): 9415.51
    ACD/KOC (pH 5.5): 24325.79
    ACD/LogD (pH 7.4): 5.53
    ACD/BCF (pH 7.4): 9415.54
    ACD/KOC (pH 7.4): 24325.84
    Polar Surface Area: 101 Å2
    Polarizability: 42.7±0.5 10-24cm3
    Surface Tension: 66.1±3.0 dyne/cm
    Molar Volume: 280.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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