ChemSpider 2D Image | Methyl 3-chloro-1,2-oxazole-5-carboxylate | C5H4ClNO3

Methyl 3-chloro-1,2-oxazole-5-carboxylate

  • Molecular FormulaC5H4ClNO3
  • Average mass161.543 Da
  • Monoisotopic mass160.987976 Da
  • ChemSpider ID24214634

More details:

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

3-Chloro-1,2-oxazole-5-carboxylate de méthyle [French] [ACD/IUPAC Name]
5-Isoxazolecarboxylic acid, 3-chloro-, methyl ester [ACD/Index Name]
96735-12-5 [RN]
Methyl 3-chloro-1,2-oxazole-5-carboxylate [ACD/IUPAC Name]
Methyl-3-chlor-1,2-oxazol-5-carboxylat [German] [ACD/IUPAC Name]
3-Chloroisoxazole-5-carboxylic acid methyl ester
3-Chloro-isoxazole-5-carboxylic acid methyl ester
5-ISOXAZOLECARBOXYLIC ACID 3-CHLORO-,METHYL ESTER
5-Isoxazolecarboxylic acid, 3-chloro-, methyl ester (9CI)
AGN-PC-00MA9E
More...

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 254.1±20.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.5 mmHg at 25°C
    Enthalpy of Vaporization: 49.2±3.0 kJ/mol
    Flash Point: 107.5±21.8 °C
    Index of Refraction: 1.490
    Molar Refractivity: 33.3±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 2
    #Rule of 5 Violations: 0
    ACD/LogP: 0.51
    ACD/LogD (pH 5.5): 0.79
    ACD/BCF (pH 5.5): 2.36
    ACD/KOC (pH 5.5): 64.39
    ACD/LogD (pH 7.4): 0.79
    ACD/BCF (pH 7.4): 2.36
    ACD/KOC (pH 7.4): 64.39
    Polar Surface Area: 52 Å2
    Polarizability: 13.2±0.5 10-24cm3
    Surface Tension: 43.5±3.0 dyne/cm
    Molar Volume: 115.3±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement