ChemSpider 2D Image | (4E)-3-(Chloromethyl)-4-(2-ethoxybenzylidene)-1,2-oxazol-5(4H)-one | C13H12ClNO3

(4E)-3-(Chloromethyl)-4-(2-ethoxybenzylidene)-1,2-oxazol-5(4H)-one

  • Molecular FormulaC13H12ClNO3
  • Average mass265.692 Da
  • Monoisotopic mass265.050568 Da
  • ChemSpider ID21801163

  • Double-bond stereo - Double-bond stereo

More details:

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

(4E)-3-(Chlormethyl)-4-(2-ethoxybenzyliden)-1,2-oxazol-5(4H)-on [German] [ACD/IUPAC Name]
(4E)-3-(Chloromethyl)-4-(2-ethoxybenzylidene)-1,2-oxazol-5(4H)-one [ACD/IUPAC Name]
(4E)-3-(Chlorométhyl)-4-(2-éthoxybenzylidène)-1,2-oxazol-5(4H)-one [French] [ACD/IUPAC Name]
(4E)-3-(chloromethyl)-4-[(2-ethoxyphenyl)methylidene]-1,2-oxazol-5-one
(4E)-3-(chloromethyl)-4-[(2-ethoxyphenyl)methylidene]-4,5-dihydro-1,2-oxazol-5-one
1142199-18-5 [RN]
5(4H)-Isoxazolone, 3-(chloromethyl)-4-[(2-ethoxyphenyl)methylene]-, (4E)- [ACD/Index Name]
(4E)-3-(chloromethyl)-4-(2-ethoxybenzylidene)isoxazol-5(4H)-one
(4E)-3-(Chloromethyl)-4-(2-ethoxybenzylidene)-isoxazol-5(4H)-one
(E)-3-(chloromethyl)-4-(2-ethoxybenzylidene)isoxazol-5(4H)-one
More...

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

MFCD12027794 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 377.4±52.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.9 mmHg at 25°C
    Enthalpy of Vaporization: 62.5±3.0 kJ/mol
    Flash Point: 182.1±30.7 °C
    Index of Refraction: 1.571
    Molar Refractivity: 68.5±0.5 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 3.06
    ACD/LogD (pH 5.5): 2.89
    ACD/BCF (pH 5.5): 92.29
    ACD/KOC (pH 5.5): 887.69
    ACD/LogD (pH 7.4): 2.89
    ACD/BCF (pH 7.4): 92.29
    ACD/KOC (pH 7.4): 887.69
    Polar Surface Area: 48 Å2
    Polarizability: 27.1±0.5 10-24cm3
    Surface Tension: 42.5±7.0 dyne/cm
    Molar Volume: 208.3±7.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement