ChemSpider 2D Image | 4-Methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxylic acid | C10H9NO4

4-Methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxylic acid

  • Molecular FormulaC10H9NO4
  • Average mass207.183 Da
  • Monoisotopic mass207.053162 Da
  • ChemSpider ID21436553

More details:

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

2H-1,4-Benzoxazine-6-carboxylic acid, 3,4-dihydro-4-methyl-3-oxo- [ACD/Index Name]
4-Methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-carbonsäure [German] [ACD/IUPAC Name]
4-Methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxylic acid [ACD/IUPAC Name]
4-Methyl-3-oxo-3,4-dihydro-2H-benzo[b][1,4]oxazine-6-carboxylic acid
861338-27-4 [RN]
Acide 4-méthyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazine-6-carboxylique [French] [ACD/IUPAC Name]
MFCD10037671 [MDL number]
[861338-27-4] [RN]
4-methyl-3-oxo-1,4-benzoxazine-6-carboxylic acid
4-methyl-3-oxo-2H-1,4-benzoxazine-6-carboxylic acid
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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: 525.6±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 84.2±3.0 kJ/mol
    Flash Point: 271.6±30.1 °C
    Index of Refraction: 1.605
    Molar Refractivity: 50.8±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 1
    #Freely Rotating Bonds: 1
    #Rule of 5 Violations: 0
    ACD/LogP: 1.09
    ACD/LogD (pH 5.5): -0.12
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 5.36
    ACD/LogD (pH 7.4): -1.69
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 67 Å2
    Polarizability: 20.1±0.5 10-24cm3
    Surface Tension: 56.9±3.0 dyne/cm
    Molar Volume: 147.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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