ChemSpider 2D Image | ethyl 5-(3-nitrophenyl)oxazole-4-carboxylate | C12H10N2O5

ethyl 5-(3-nitrophenyl)oxazole-4-carboxylate

  • Molecular FormulaC12H10N2O5
  • Average mass262.218 Da
  • Monoisotopic mass262.058960 Da
  • ChemSpider ID21473019

More details:

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

4-Oxazolecarboxylic acid, 5-(3-nitrophenyl)-, ethyl ester [ACD/Index Name]
5-(3-Nitrophényl)-1,3-oxazole-4-carboxylate d'éthyle [French] [ACD/IUPAC Name]
5-(3-Nitro-phenyl)-oxazole-4-carboxylic acid ethyl ester
916674-05-0 [RN]
Ethyl 5-(3-nitrophenyl)-1,3-oxazole-4-carboxylate [ACD/IUPAC Name]
ethyl 5-(3-nitrophenyl)oxazole-4-carboxylate
Ethyl-5-(3-nitrophenyl)-1,3-oxazol-4-carboxylat [German] [ACD/IUPAC Name]
[916674-05-0] [RN]
4-Oxazolecarboxylicacid,5-(3-nitrophenyl)-,ethylester
ethyl5-(3-nitrophenyl)-1,3-oxazole-4-carboxylate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

CCRIS 4693 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 438.9±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 69.6±3.0 kJ/mol
    Flash Point: 219.2±27.3 °C
    Index of Refraction: 1.565
    Molar Refractivity: 64.2±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 1.62
    ACD/LogD (pH 5.5): 1.93
    ACD/BCF (pH 5.5): 17.16
    ACD/KOC (pH 5.5): 266.27
    ACD/LogD (pH 7.4): 1.93
    ACD/BCF (pH 7.4): 17.16
    ACD/KOC (pH 7.4): 266.27
    Polar Surface Area: 98 Å2
    Polarizability: 25.4±0.5 10-24cm3
    Surface Tension: 52.0±3.0 dyne/cm
    Molar Volume: 197.0±3.0 cm3

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