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Search term: MF = 'C_{13}H_{17}ClO_{3}'

ChemSpider 2D Image | 3-Methoxy-4-(pentyloxy)benzoyl chloride | C13H17ClO3

3-Methoxy-4-(pentyloxy)benzoyl chloride

  • Molecular FormulaC13H17ClO3
  • Average mass256.725 Da
  • Monoisotopic mass256.086609 Da
  • ChemSpider ID23079351

More details:






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

3-Methoxy-4-(pentyloxy)benzoyl chloride [ACD/IUPAC Name]
3-Methoxy-4-(pentyloxy)benzoylchlorid [German] [ACD/IUPAC Name]
Benzoyl chloride, 3-methoxy-4-(pentyloxy)- [ACD/Index Name]
Chlorure de 3-méthoxy-4-(pentyloxy)benzoyle [French] [ACD/IUPAC Name]
113628-74-3 [RN]
3-Methoxy-4-n-pentoxybenzoyl chloride
3-methoxy-4-pentoxybenzoyl chloride
3-methoxy-4-pentyloxybenzoyl chloride
benzoyl chloride, 3-methoxy-4-(pentyloxy)
MFCD11941911 [MDL number]
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.1±0.1 g/cm3
    Boiling Point: 356.2±22.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.8 mmHg at 25°C
    Enthalpy of Vaporization: 60.1±3.0 kJ/mol
    Flash Point: 138.0±21.3 °C
    Index of Refraction: 1.507
    Molar Refractivity: 68.4±0.3 cm3
    #H bond acceptors: 3
    #H bond donors: 0
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 4.57
    ACD/LogD (pH 5.5): 4.37
    ACD/BCF (pH 5.5): 1225.49
    ACD/KOC (pH 5.5): 5652.12
    ACD/LogD (pH 7.4): 4.37
    ACD/BCF (pH 7.4): 1225.49
    ACD/KOC (pH 7.4): 5652.12
    Polar Surface Area: 36 Å2
    Polarizability: 27.1±0.5 10-24cm3
    Surface Tension: 36.1±3.0 dyne/cm
    Molar Volume: 229.9±3.0 cm3

    Click to predict properties on the Chemicalize site






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