ChemSpider 2D Image | Methyl 2-(4-Nitrophenyl)oxazole-4-carboxylate | C11H8N2O5

Methyl 2-(4-Nitrophenyl)oxazole-4-carboxylate

  • Molecular FormulaC11H8N2O5
  • Average mass248.192 Da
  • Monoisotopic mass248.043320 Da
  • ChemSpider ID32741201

More details:

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

1171126-87-6 [RN]
2-(4-Nitrophényl)-1,3-oxazole-4-carboxylate de méthyle [French] [ACD/IUPAC Name]
4-Oxazolecarboxylic acid, 2-(4-nitrophenyl)-, methyl ester [ACD/Index Name]
Methyl 2-(4-nitrophenyl)-1,3-oxazole-4-carboxylate [ACD/IUPAC Name]
Methyl 2-(4-Nitrophenyl)oxazole-4-carboxylate
Methyl-2-(4-nitrophenyl)-1,3-oxazol-4-carboxylat [German] [ACD/IUPAC Name]
CS-11843
methyl2-(4-nitrophenyl)oxazole-4-carboxylate
MFCD28122819 [MDL number]

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: 1.4±0.1 g/cm3
    Boiling Point: 412.6±51.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 66.5±3.0 kJ/mol
    Flash Point: 203.3±30.4 °C
    Index of Refraction: 1.574
    Molar Refractivity: 59.6±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 2.30
    ACD/LogD (pH 5.5): 1.98
    ACD/BCF (pH 5.5): 18.76
    ACD/KOC (pH 5.5): 283.77
    ACD/LogD (pH 7.4): 1.98
    ACD/BCF (pH 7.4): 18.76
    ACD/KOC (pH 7.4): 283.77
    Polar Surface Area: 98 Å2
    Polarizability: 23.6±0.5 10-24cm3
    Surface Tension: 53.9±3.0 dyne/cm
    Molar Volume: 180.5±3.0 cm3

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