ChemSpider 2D Image | 2-chloro-4-methyloxazole | C4H4ClNO

2-chloro-4-methyloxazole

  • Molecular FormulaC4H4ClNO
  • Average mass117.534 Da
  • Monoisotopic mass116.998138 Da
  • ChemSpider ID29338564

More details:

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

1060816-10-5 [RN]
2-Chlor-4-methyl-1,3-oxazol [German] [ACD/IUPAC Name]
2-Chloro-4-methyl-1,3-oxazole [ACD/IUPAC Name]
2-Chloro-4-méthyl-1,3-oxazole [French] [ACD/IUPAC Name]
2-chloro-4-methyloxazole
Oxazole, 2-chloro-4-methyl- [ACD/Index Name]
atoms 7 bonds 7
MFCD13189379 [MDL number]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 166.8±33.0 °C at 760 mmHg
    Vapour Pressure: 2.3±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 38.7±3.0 kJ/mol
    Flash Point: 54.7±25.4 °C
    Index of Refraction: 1.475
    Molar Refractivity: 26.4±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 0
    #Rule of 5 Violations: 0
    ACD/LogP: 1.64
    ACD/LogD (pH 5.5): 1.39
    ACD/BCF (pH 5.5): 6.66
    ACD/KOC (pH 5.5): 135.23
    ACD/LogD (pH 7.4): 1.39
    ACD/BCF (pH 7.4): 6.66
    ACD/KOC (pH 7.4): 135.23
    Polar Surface Area: 26 Å2
    Polarizability: 10.5±0.5 10-24cm3
    Surface Tension: 35.7±3.0 dyne/cm
    Molar Volume: 93.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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