ChemSpider 2D Image | (2E)-3-{3-Chloro-4-[(4-fluorobenzyl)oxy]phenyl}acryloyl chloride | C16H11Cl2FO2

(2E)-3-{3-Chloro-4-[(4-fluorobenzyl)oxy]phenyl}acryloyl chloride

  • Molecular FormulaC16H11Cl2FO2
  • Average mass325.162 Da
  • Monoisotopic mass324.012024 Da
  • ChemSpider ID35510312

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-{3-Chlor-4-[(4-fluorbenzyl)oxy]phenyl}acryloylchlorid [German] [ACD/IUPAC Name]
(2E)-3-{3-Chloro-4-[(4-fluorobenzyl)oxy]phenyl}acryloyl chloride [ACD/IUPAC Name]
2-Propenoyl chloride, 3-[3-chloro-4-[(4-fluorophenyl)methoxy]phenyl]-, (2E)- [ACD/Index Name]
Chlorure de (2E)-3-{3-chloro-4-[(4-fluorobenzyl)oxy]phényl}acryloyle [French] [ACD/IUPAC Name]
(2E)-3-{3-CHLORO-4-[(4-FLUOROPHENYL)METHOXY]PHENYL}PROP-2-ENOYL CHLORIDE
(E)-3-(3-chloro-4-((4-fluorobenzyl)oxy)phenyl)acryloyl chloride
3-[3-Chloro-4-(4-fluoro-benzyloxy)-phenyl]-acryloyl chloride
MFCD28250762

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 462.3±45.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.1 mmHg at 25°C
    Enthalpy of Vaporization: 72.3±3.0 kJ/mol
    Flash Point: 187.9±17.9 °C
    Index of Refraction: 1.609
    Molar Refractivity: 83.1±0.3 cm3
    #H bond acceptors: 2
    #H bond donors: 0
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 1
    ACD/LogP: 5.40
    ACD/LogD (pH 5.5): 4.96
    ACD/BCF (pH 5.5): 3468.81
    ACD/KOC (pH 5.5): 11902.99
    ACD/LogD (pH 7.4): 4.96
    ACD/BCF (pH 7.4): 3468.81
    ACD/KOC (pH 7.4): 11902.99
    Polar Surface Area: 26 Å2
    Polarizability: 32.9±0.5 10-24cm3
    Surface Tension: 46.3±3.0 dyne/cm
    Molar Volume: 239.8±3.0 cm3

    Click to predict properties on the Chemicalize site


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