ChemSpider 2D Image | Allyl 3-chloro-5-ethoxy-4-[(2-methylbenzyl)oxy]benzoate | C20H21ClO4

Allyl 3-chloro-5-ethoxy-4-[(2-methylbenzyl)oxy]benzoate

  • Molecular FormulaC20H21ClO4
  • Average mass360.831 Da
  • Monoisotopic mass360.112823 Da
  • ChemSpider ID35502998

More details:

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

3-Chloro-5-éthoxy-4-[(2-méthylbenzyl)oxy]benzoate d'allyle [French] [ACD/IUPAC Name]
Allyl 3-chloro-5-ethoxy-4-[(2-methylbenzyl)oxy]benzoate [ACD/IUPAC Name]
Allyl-3-chlor-5-ethoxy-4-[(2-methylbenzyl)oxy]benzoat [German] [ACD/IUPAC Name]
Benzoic acid, 3-chloro-5-ethoxy-4-[(2-methylphenyl)methoxy]-, 2-propen-1-yl ester [ACD/Index Name]
1706438-27-8 [RN]
3-Chloro-5-ethoxy-4-(2-methyl-benzyloxy)-benzoic acid allyl ester
AKOS025131704
Allyl 3-chloro-5-ethoxy-4-((2-methylbenzyl)oxy)benzoate
benzoic acid, 3-chloro-5-ethoxy-4-[(2-methylphenyl)methoxy]-, 2-propenyl ester
MFCD28102336
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.2±0.1 g/cm3
    Boiling Point: 490.0±40.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.2 mmHg at 25°C
    Enthalpy of Vaporization: 75.6±3.0 kJ/mol
    Flash Point: 175.4±26.3 °C
    Index of Refraction: 1.556
    Molar Refractivity: 99.2±0.3 cm3
    #H bond acceptors: 4
    #H bond donors: 0
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 1
    ACD/LogP: 6.37
    ACD/LogD (pH 5.5): 5.44
    ACD/BCF (pH 5.5): 8028.31
    ACD/KOC (pH 5.5): 21703.02
    ACD/LogD (pH 7.4): 5.44
    ACD/BCF (pH 7.4): 8028.31
    ACD/KOC (pH 7.4): 21703.02
    Polar Surface Area: 45 Å2
    Polarizability: 39.3±0.5 10-24cm3
    Surface Tension: 40.6±3.0 dyne/cm
    Molar Volume: 308.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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