ChemSpider 2D Image | Ethyl 3-bromo-5-methyl-1,2-oxazole-4-carboxylate | C7H8BrNO3

Ethyl 3-bromo-5-methyl-1,2-oxazole-4-carboxylate

  • Molecular FormulaC7H8BrNO3
  • Average mass234.047 Da
  • Monoisotopic mass232.968750 Da
  • ChemSpider ID35491354

More details:

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

1254962-88-3 [RN]
3-Bromo-5-méthyl-1,2-oxazole-4-carboxylate d'éthyle [French] [ACD/IUPAC Name]
4-Isoxazolecarboxylic acid, 3-bromo-5-methyl-, ethyl ester [ACD/Index Name]
Ethyl 3-bromo-5-methyl-1,2-oxazole-4-carboxylate [ACD/IUPAC Name]
Ethyl-3-brom-5-methyl-1,2-oxazol-4-carboxylat [German] [ACD/IUPAC Name]
3-Bromo-5-methyl-isoxazole-4-carboxylic acid ethyl ester
AGN-PC-0H28IF
Ethyl 3-bromo-5-methylisoxazole-4-carboxylate
LURPTDYVMCBBPQ-UHFFFAOYSA-N
MFCD25949305
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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: 283.3±35.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.6 mmHg at 25°C
    Enthalpy of Vaporization: 52.2±3.0 kJ/mol
    Flash Point: 125.1±25.9 °C
    Index of Refraction: 1.510
    Molar Refractivity: 45.6±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 3
    #Rule of 5 Violations: 0
    ACD/LogP: 1.40
    ACD/LogD (pH 5.5): 1.84
    ACD/BCF (pH 5.5): 14.75
    ACD/KOC (pH 5.5): 238.90
    ACD/LogD (pH 7.4): 1.84
    ACD/BCF (pH 7.4): 14.75
    ACD/KOC (pH 7.4): 238.90
    Polar Surface Area: 52 Å2
    Polarizability: 18.1±0.5 10-24cm3
    Surface Tension: 42.2±3.0 dyne/cm
    Molar Volume: 152.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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