ChemSpider 2D Image | Methyl 3-(1,2-oxazol-3-ylmethyl)-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylate | C13H10N2O5

Methyl 3-(1,2-oxazol-3-ylmethyl)-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylate

  • Molecular FormulaC13H10N2O5
  • Average mass274.229 Da
  • Monoisotopic mass274.058960 Da
  • ChemSpider ID22752465

More details:

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

1020243-01-9 [RN]
3-(1,2-Oxazol-3-ylméthyl)-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
5-Benzoxazolecarboxylic acid, 2,3-dihydro-3-(3-isoxazolylmethyl)-2-oxo-, methyl ester [ACD/Index Name]
Methyl 3-(1,2-oxazol-3-ylmethyl)-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylate [ACD/IUPAC Name]
methyl 3-[(1,2-oxazol-3-yl)methyl]-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylate
Methyl-3-(1,2-oxazol-3-ylmethyl)-2-oxo-2,3-dihydro-1,3-benzoxazol-5-carboxylat [German] [ACD/IUPAC Name]
3-Isoxazol-3-ylmethyl-2-oxo-2,3-dihydro-benzooxazole-5-carboxylic acid methyl ester
methyl 3-(1,2-oxazol-3-ylmethyl)-2-oxo-1,3-benzoxazole-5-carboxylate
methyl 3-(3-isoxazolylmethyl)-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylate
methyl 3-(isoxazol-3-ylmethyl)-2-oxo-2,3-dihydro-1,3-benzoxazole-5-carboxylate
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.4±0.1 g/cm3
    Boiling Point: 481.8±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 74.7±3.0 kJ/mol
    Flash Point: 245.2±31.5 °C
    Index of Refraction: 1.612
    Molar Refractivity: 65.8±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 0.80
    ACD/LogD (pH 5.5): 1.52
    ACD/BCF (pH 5.5): 8.41
    ACD/KOC (pH 5.5): 159.86
    ACD/LogD (pH 7.4): 1.52
    ACD/BCF (pH 7.4): 8.41
    ACD/KOC (pH 7.4): 159.86
    Polar Surface Area: 82 Å2
    Polarizability: 26.1±0.5 10-24cm3
    Surface Tension: 62.7±3.0 dyne/cm
    Molar Volume: 189.3±3.0 cm3

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