ChemSpider 2D Image | Allyl (2E)-3-(3,4-dichloro-5-nitrophenyl)acrylate | C12H9Cl2NO4

Allyl (2E)-3-(3,4-dichloro-5-nitrophenyl)acrylate

  • Molecular FormulaC12H9Cl2NO4
  • Average mass302.110 Da
  • Monoisotopic mass300.990875 Da
  • ChemSpider ID35510893
  • Double-bond stereo - Double-bond stereo


More details:






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

(2E)-3-(3,4-Dichloro-5-nitrophényl)acrylate d'allyle [French] [ACD/IUPAC Name]
2-Propenoic acid, 3-(3,4-dichloro-5-nitrophenyl)-, 2-propen-1-yl ester, (2E)- [ACD/Index Name]
Allyl (2E)-3-(3,4-dichloro-5-nitrophenyl)acrylate [ACD/IUPAC Name]
Allyl-(2E)-3-(3,4-dichlor-5-nitrophenyl)acrylat [German] [ACD/IUPAC Name]
(E)-allyl 3-(3,4-dichloro-5-nitrophenyl)acrylate
2-propenoic acid, 3-(3,4-dichloro-5-nitrophenyl)-, 2-propenyl ester, (2E)-
3-(3,4-Dichloro-5-nitro-phenyl)-acrylic acid allyl ester
MFCD28251322

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 423.3±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.0 mmHg at 25°C
    Enthalpy of Vaporization: 67.8±3.0 kJ/mol
    Flash Point: 209.8±28.7 °C
    Index of Refraction: 1.606
    Molar Refractivity: 73.9±0.3 cm3
    #H bond acceptors: 5
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 3.72
    ACD/LogD (pH 5.5): 3.76
    ACD/BCF (pH 5.5): 421.74
    ACD/KOC (pH 5.5): 2633.98
    ACD/LogD (pH 7.4): 3.76
    ACD/BCF (pH 7.4): 421.74
    ACD/KOC (pH 7.4): 2633.98
    Polar Surface Area: 72 Å2
    Polarizability: 29.3±0.5 10-24cm3
    Surface Tension: 50.3±3.0 dyne/cm
    Molar Volume: 214.2±3.0 cm3

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